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Details

Stereochemistry ACHIRAL
Molecular Formula C33H30N4O2
Molecular Weight 514.6169
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 4?-[(7?-methyl-2?-propyl[2,5?-bi-1H-benzimidazol]-3?-yl)methyl][1,1?-biphenyl]-2-carboxylate

SMILES

CCCC1=NC2=C(C=C(C=C2C)C3=NC4=C(N3)C=CC=C4)N1CC5=CC=C(C=C5)C6=CC=CC=C6C(=O)OC

InChI

InChIKey=DZZFSVYNGXFMNV-UHFFFAOYSA-N
InChI=1S/C33H30N4O2/c1-4-9-30-36-31-21(2)18-24(32-34-27-12-7-8-13-28(27)35-32)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39-3/h5-8,10-19H,4,9,20H2,1-3H3,(H,34,35)

HIDE SMILES / InChI

Molecular Formula C33H30N4O2
Molecular Weight 514.6169
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
E9829M3UXM
Record Status Validated (UNII)
Record Version