4-methyl-N-(2-methylpropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-methyl-N-(2-methylpropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide CAS Name: 4-methyl-N-(2-methylpropyl)-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-4-methyl-N-(2-methylpropyl)-3-nitrobenzamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-isobutyl-4-methyl-3-nitro-benzamide Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CN3C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(CC(C)C)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CN3C)[N+](=O)[O-]

InChI

InChI=1S/C27H32N4O4/c1-20(2)16-30(27(33)23-13-12-21(3)25(15-23)31(34)35)19-26(32)29(17-22-9-6-5-7-10-22)18-24-11-8-14-28(24)4/h5-15,20H,16-19H2,1-4H3