1-[3-(dimethylamino)propyl]-3-(diphenylmethyl)-5-nitro-N-(4-propylphenyl)indole-2-carboxamide

Systemtic Name: 1-[3-(dimethylamino)propyl]-3-(diphenylmethyl)-5-nitro-N-(4-propylphenyl)indole-2-carboxamide Openeye Name: 3-benzhydryl-1-[3-(dimethylamino)propyl]-5-nitro-N-(4-propylphenyl)indole-2-carboxamide CAS Name: 1-[3-(dimethylamino)propyl]-3-(diphenylmethyl)-5-nitro-N-(4-propylphenyl)-2-indolecarboxamide IUPAC Name: 3-benzhydryl-1-[3-(dimethylamino)propyl]-5-nitro-N-(4-propylphenyl)indole-2-carboxamide Traditional Name: 3-benzhydryl-1-[3-(dimethylamino)propyl]-5-nitro-N-(4-propylphenyl)indole-2-carboxamide Formula: C36H38N4O3 MolecularWeight: 574.71192

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N2CCCN(C)C)C=CC(=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(N2CCCN(C)C)C=CC(=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H38N4O3/c1-4-12-26-17-19-29(20-18-26)37-36(41)35-34(33(27-13-7-5-8-14-27)28-15-9-6-10-16-28)31-25-30(40(42)43)21-22-32(31)39(35)24-11-23-38(2)3/h5-10,13-22,25,33H,4,11-12,23-24H2,1-3H3,(H,37,41)