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

Systemtic Name: N-(3-ethoxypropyl)-4-methyl-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-(3-ethoxypropyl)-4-methyl-3-nitro-benzamide CAS Name: N-(3-ethoxypropyl)-4-methyl-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]-N-(3-ethoxypropyl)-4-methyl-3-nitrobenzamide Traditional Name: N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-N-(3-ethoxypropyl)-4-methyl-3-nitro-benzamide Formula: C28H34N4O5 MolecularWeight: 506.59336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O5/c1-4-37-17-9-16-30(28(34)24-14-13-22(2)26(18-24)32(35)36)21-27(33)31(19-23-10-6-5-7-11-23)20-25-12-8-15-29(25)3/h5-8,10-15,18H,4,9,16-17,19-21H2,1-3H3