1-cyclohexyl-N3-cyclopropyl-4-oxidanylidene-N5-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyridine-3,5-dicarboxamide

Systemtic Name: 1-cyclohexyl-N3-cyclopropyl-4-oxidanylidene-N5-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyridine-3,5-dicarboxamide Openeye Name: 1-cyclohexyl-N3-cyclopropyl-4-oxo-N5-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]pyridine-3,5-dicarboxamide CAS Name: 1-cyclohexyl-N3-cyclopropyl-4-oxo-N5-[(2R)-2-phenyl-2-(1-piperidin-1-iumyl)ethyl]pyridine-3,5-dicarboxamide IUPAC Name: 1-cyclohexyl-3-N-cyclopropyl-4-oxo-5-N-[(2R)-2-phenyl-2-piperidin-1-ium-1-ylethyl]pyridine-3,5-dicarboxamide Traditional Name: 1-cyclohexyl-N-cyclopropyl-4-keto-N'-[(2R)-2-phenyl-2-piperidin-1-ium-1-yl-ethyl]dinicotinamide Formula: C29H39N4O3+ MolecularWeight: 491.64496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=C(C(=O)C(=C2)C(=O)NC3CC3)C(=O)NCC(C4=CC=CC=C4)[NH+]5CCCCC5

Isomeric SMILES

C1CCC(CC1)N2C=C(C(=O)C(=C2)C(=O)NC3CC3)C(=O)NC[C@@H](C4=CC=CC=C4)[NH+]5CCCCC5

InChI

InChI=1S/C29H38N4O3/c34-27-24(19-33(23-12-6-2-7-13-23)20-25(27)29(36)31-22-14-15-22)28(35)30-18-26(21-10-4-1-5-11-21)32-16-8-3-9-17-32/h1,4-5,10-11,19-20,22-23,26H,2-3,6-9,12-18H2,(H,30,35)(H,31,36)/p+1/t26-/m0/s1