N-[2-(1H-indol-3-yl)ethyl]-2-[(4-nitrophenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(4-nitrophenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[isopropyl-[(4-nitrophenyl)carbamoyl]amino]acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[(4-nitroanilino)-oxomethyl]-propan-2-ylamino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[(4-nitrophenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[isopropyl-[(4-nitrophenyl)carbamoyl]amino]acetamide Formula: C29H31N5O4 MolecularWeight: 513.58754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C29H31N5O4/c1-21(2)33(29(36)31-24-12-14-25(15-13-24)34(37)38)20-28(35)32(19-22-8-4-3-5-9-22)17-16-23-18-30-27-11-7-6-10-26(23)27/h3-15,18,21,30H,16-17,19-20H2,1-2H3,(H,31,36)