N-[(4-tert-butylphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[(4-tert-butylphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitro-benzamide CAS Name: N-[(4-tert-butylphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(4-tert-butylphenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitrobenzamide Traditional Name: N-(4-tert-butylbenzyl)-N-[2-(1H-indol-3-yl)ethyl]-4-methyl-3-nitro-benzamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CCC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)C(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CCC2=CNC3=CC=CC=C32)CC4=CC=C(C=C4)C(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C29H31N3O3/c1-20-9-12-22(17-27(20)32(34)35)28(33)31(19-21-10-13-24(14-11-21)29(2,3)4)16-15-23-18-30-26-8-6-5-7-25(23)26/h5-14,17-18,30H,15-16,19H2,1-4H3