6-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]amino]pyridine-3-carboxylic acid

Systemtic Name: 6-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-4-yl]amino]pyridine-3-carboxylic acid Openeye Name: 6-[[1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-piperidyl]amino]pyridine-3-carboxylic acid CAS Name: 6-[[1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-piperidinyl]amino]-3-pyridinecarboxylic acid IUPAC Name: 6-[[1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-4-yl]amino]pyridine-3-carboxylic acid Traditional Name: 6-[[1-(3-ethoxy-4-methoxy-benzyl)-4-piperidyl]amino]nicotinic acid Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=NC=C(C=C3)C(=O)O)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCC(CC2)NC3=NC=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C21H27N3O4/c1-3-28-19-12-15(4-6-18(19)27-2)14-24-10-8-17(9-11-24)23-20-7-5-16(13-22-20)21(25)26/h4-7,12-13,17H,3,8-11,14H2,1-2H3,(H,22,23)(H,25,26)