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

Systemtic Name: N-butyl-4-chloranyl-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-butyl-4-chloro-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-butyl-4-chloro-N-[2-[2-methylpropyl-[(1-methyl-2-pyrrolyl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-butyl-4-chloro-N-[2-[2-methylpropyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-butyl-4-chloro-N-[2-[isobutyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C23H31ClN4O4 MolecularWeight: 462.96964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)N(CC1=CC=CN1C)CC(C)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCN(CC(=O)N(CC1=CC=CN1C)CC(C)C)C(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H31ClN4O4/c1-5-6-12-26(23(30)18-9-10-20(24)21(13-18)28(31)32)16-22(29)27(14-17(2)3)15-19-8-7-11-25(19)4/h7-11,13,17H,5-6,12,14-16H2,1-4H3