6-azanyl-5-chloranyl-2-methoxy-N-[1-[(1-pyrrolidin-1-ylcarbonylpiperidin-4-yl)methyl]piperidin-4-yl]pyridine-3-carboxamide; (E)-but-2-enedioic acid

Systemtic Name: 6-azanyl-5-chloranyl-2-methoxy-N-[1-[(1-pyrrolidin-1-ylcarbonylpiperidin-4-yl)methyl]piperidin-4-yl]pyridine-3-carboxamide; (E)-but-2-enedioic acid Openeye Name: 6-amino-5-chloro-2-methoxy-N-[1-[[1-(pyrrolidine-1-carbonyl)-4-piperidyl]methyl]-4-piperidyl]pyridine-3-carboxamide; fumaric acid CAS Name: 6-amino-5-chloro-2-methoxy-N-[1-[[1-[oxo(1-pyrrolidinyl)methyl]-4-piperidinyl]methyl]-4-piperidinyl]-3-pyridinecarboxamide; (E)-2-butenedioic acid IUPAC Name: 6-amino-5-chloro-2-methoxy-N-[1-[[1-(pyrrolidine-1-carbonyl)piperidin-4-yl]methyl]piperidin-4-yl]pyridine-3-carboxamide; (E)-but-2-enedioic acid Traditional Name: 6-amino-5-chloro-2-methoxy-N-[1-[[1-(pyrrolidine-1-carbonyl)-4-piperidyl]methyl]-4-piperidyl]nicotinamide; fumaric acid Formula: C27H39ClN6O7 MolecularWeight: 595.08756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)N4CCCC4)Cl)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

COC1=NC(=C(C=C1C(=O)NC2CCN(CC2)CC3CCN(CC3)C(=O)N4CCCC4)Cl)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C23H35ClN6O3.C4H4O4/c1-33-22-18(14-19(24)20(25)27-22)21(31)26-17-6-10-28(11-7-17)15-16-4-12-30(13-5-16)23(32)29-8-2-3-9-29;5-3(6)1-2-4(7)8/h14,16-17H,2-13,15H2,1H3,(H2,25,27)(H,26,31);1-2H,(H,5,6)(H,7,8)/b;2-1+