N-(3-methoxypropyl)-6-methyl-2-[1-[(3-nitro-4-oxidanyl-phenyl)methyl]piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(3-methoxypropyl)-6-methyl-2-[1-[(3-nitro-4-oxidanyl-phenyl)methyl]piperidin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[1-[(4-hydroxy-3-nitro-phenyl)methyl]-4-piperidyl]-N-(3-methoxypropyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[(4-hydroxy-3-nitrophenyl)methyl]-4-piperidinyl]-N-(3-methoxypropyl)-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-[(4-hydroxy-3-nitrophenyl)methyl]piperidin-4-yl]-N-(3-methoxypropyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(4-hydroxy-3-nitro-benzyl)-4-piperidyl]-N-(3-methoxypropyl)-6-methyl-nicotinamide Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCOC)C2CCN(CC2)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCOC)C2CCN(CC2)CC3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O5/c1-16-4-6-19(23(29)24-10-3-13-32-2)22(25-16)18-8-11-26(12-9-18)15-17-5-7-21(28)20(14-17)27(30)31/h4-7,14,18,28H,3,8-13,15H2,1-2H3,(H,24,29)