[5-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)hexan-2-yl]-2-ethoxycarbonyl-phenyl] pyridine-3-carboxylate

Systemtic Name: [5-[1-azanyl-1-oxidanylidene-3-(2-piperidin-1-ylphenyl)hexan-2-yl]-2-ethoxycarbonyl-phenyl] pyridine-3-carboxylate Openeye Name: [5-[1-carbamoyl-2-[2-(1-piperidyl)phenyl]pentyl]-2-ethoxycarbonyl-phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [5-[1-amino-1-oxo-3-[2-(1-piperidinyl)phenyl]hexan-2-yl]-2-ethoxycarbonylphenyl] ester IUPAC Name: [5-[1-amino-1-oxo-3-(2-piperidin-1-ylphenyl)hexan-2-yl]-2-ethoxycarbonylphenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [5-[1-carbamoyl-2-(2-piperidinophenyl)pentyl]-2-carbethoxy-phenyl] ester Formula: C32H37N3O5 MolecularWeight: 543.65328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1N2CCCCC2)C(C3=CC(=C(C=C3)C(=O)OCC)OC(=O)C4=CN=CC=C4)C(=O)N

Isomeric SMILES

CCCC(C1=CC=CC=C1N2CCCCC2)C(C3=CC(=C(C=C3)C(=O)OCC)OC(=O)C4=CN=CC=C4)C(=O)N

InChI

InChI=1S/C32H37N3O5/c1-3-11-25(24-13-6-7-14-27(24)35-18-8-5-9-19-35)29(30(33)36)22-15-16-26(32(38)39-4-2)28(20-22)40-31(37)23-12-10-17-34-21-23/h6-7,10,12-17,20-21,25,29H,3-5,8-9,11,18-19H2,1-2H3,(H2,33,36)