N-(3-methoxyphenyl)-4-[6-(2-morpholin-4-ylethylamino)-5-nitro-pyridin-2-yl]piperazine-1-carboxamide

Systemtic Name: N-(3-methoxyphenyl)-4-[6-(2-morpholin-4-ylethylamino)-5-nitro-pyridin-2-yl]piperazine-1-carboxamide Openeye Name: N-(3-methoxyphenyl)-4-[6-(2-morpholinoethylamino)-5-nitro-2-pyridyl]piperazine-1-carboxamide CAS Name: N-(3-methoxyphenyl)-4-[6-[2-(4-morpholinyl)ethylamino]-5-nitro-2-pyridinyl]-1-piperazinecarboxamide IUPAC Name: N-(3-methoxyphenyl)-4-[6-(2-morpholin-4-ylethylamino)-5-nitropyridin-2-yl]piperazine-1-carboxamide Traditional Name: N-(3-methoxyphenyl)-4-[6-(2-morpholinoethylamino)-5-nitro-2-pyridyl]piperazine-1-carboxamide Formula: C23H31N7O5 MolecularWeight: 485.53614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NC(=C(C=C3)[N+](=O)[O-])NCCN4CCOCC4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N2CCN(CC2)C3=NC(=C(C=C3)[N+](=O)[O-])NCCN4CCOCC4

InChI

InChI=1S/C23H31N7O5/c1-34-19-4-2-3-18(17-19)25-23(31)29-11-9-28(10-12-29)21-6-5-20(30(32)33)22(26-21)24-7-8-27-13-15-35-16-14-27/h2-6,17H,7-16H2,1H3,(H,24,26)(H,25,31)