N-[3-azanyl-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide

Systemtic Name: N-[3-azanyl-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-phenyl]-3-oxidanylidene-propyl]-2,5-dimethoxy-benzamide Openeye Name: N-[3-amino-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-phenyl]-3-oxo-propyl]-2,5-dimethoxy-benzamide CAS Name: N-[3-amino-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitrophenyl]-3-oxopropyl]-2,5-dimethoxybenzamide IUPAC Name: N-[3-amino-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitrophenyl]-3-oxopropyl]-2,5-dimethoxybenzamide Traditional Name: N-[3-amino-3-keto-1-[4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-phenyl]propyl]-2,5-dimethoxy-benzamide Formula: C27H30N4O7 MolecularWeight: 522.5497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)C3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)C3=C(C=CC(=C3)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C27H30N4O7/c1-36-19-7-4-17(5-8-19)12-13-29-22-10-6-18(14-24(22)31(34)35)23(16-26(28)32)30-27(33)21-15-20(37-2)9-11-25(21)38-3/h4-11,14-15,23,29H,12-13,16H2,1-3H3,(H2,28,32)(H,30,33)