2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-nitrophenyl)carbonylamino]-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-nitrophenyl)carbonylamino]-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-nitrobenzoyl)amino]-N-(3-pyridylmethyl)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[[(4-nitrophenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)benzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-[(4-nitrobenzoyl)amino]-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]-5-[(4-nitrobenzoyl)amino]-N-(3-pyridylmethyl)benzamide Formula: C31H30N6O5 MolecularWeight: 566.6071

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)NCC5=CN=CC=C5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C31H30N6O5/c1-42-29-7-3-2-6-28(29)36-17-15-35(16-18-36)27-13-10-24(34-30(38)23-8-11-25(12-9-23)37(40)41)19-26(27)31(39)33-21-22-5-4-14-32-20-22/h2-14,19-20H,15-18,21H2,1H3,(H,33,39)(H,34,38)