2-methyl-N-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]cyclopropane-1-carboxamide

Systemtic Name: 2-methyl-N-[3-[4-(6-nitropyridin-3-yl)piperazin-1-yl]carbonylphenyl]cyclopropane-1-carboxamide Openeye Name: 2-methyl-N-[3-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]cyclopropanecarboxamide CAS Name: 2-methyl-N-[3-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-oxomethyl]phenyl]-1-cyclopropanecarboxamide IUPAC Name: 2-methyl-N-[3-[4-(6-nitropyridin-3-yl)piperazine-1-carbonyl]phenyl]cyclopropane-1-carboxamide Traditional Name: 2-methyl-N-[3-[4-(6-nitro-3-pyridyl)piperazine-1-carbonyl]phenyl]cyclopropanecarboxamide Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O4/c1-14-11-18(14)20(27)23-16-4-2-3-15(12-16)21(28)25-9-7-24(8-10-25)17-5-6-19(22-13-17)26(29)30/h2-6,12-14,18H,7-11H2,1H3,(H,23,27)