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

Systemtic Name: N-(3-ethoxypropyl)-N-[2-[(1-methylpyrrol-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-N-(3-ethoxypropyl)-4-nitro-benzamide CAS Name: N-(3-ethoxypropyl)-N-[2-[(1-methyl-2-pyrrolyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-(3-ethoxypropyl)-4-nitrobenzamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-(3-ethoxypropyl)-4-nitro-benzamide Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOCCCN(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CN2C)C(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C27H32N4O5/c1-3-36-18-8-17-29(27(33)23-12-14-24(15-13-23)31(34)35)21-26(32)30(19-22-9-5-4-6-10-22)20-25-11-7-16-28(25)2/h4-7,9-16H,3,8,17-21H2,1-2H3