4-acetamido-5-chloranyl-2-methoxy-N-[3-oxidanyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide ethanoate

Systemtic Name: 4-acetamido-5-chloranyl-2-methoxy-N-[3-oxidanyl-1-(pyridin-2-ylmethyl)piperidin-4-yl]benzamide ethanoate Openeye Name: 4-acetamido-5-chloro-N-[3-hydroxy-1-(2-pyridylmethyl)-4-piperidyl]-2-methoxy-benzamide acetate CAS Name: 4-acetamido-5-chloro-N-[3-hydroxy-1-(2-pyridinylmethyl)-4-piperidinyl]-2-methoxybenzamide acetate IUPAC Name: 4-acetamido-5-chloro-N-[3-hydroxy-1-(pyridin-2-ylmethyl)piperidin-4-yl]-2-methoxybenzamide acetate Traditional Name: 4-acetamido-5-chloro-N-[3-hydroxy-1-(2-pyridylmethyl)-4-piperidyl]-2-methoxy-benzamide acetate Formula: C23H28ClN4O6- MolecularWeight: 491.94462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2CCN(CC2O)CC3=CC=CC=N3)Cl.CC(=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)OC)C(=O)NC2CCN(CC2O)CC3=CC=CC=N3)Cl.CC(=O)[O-]

InChI

InChI=1S/C21H25ClN4O4.C2H4O2/c1-13(27)24-18-10-20(30-2)15(9-16(18)22)21(29)25-17-6-8-26(12-19(17)28)11-14-5-3-4-7-23-14;1-2(3)4/h3-5,7,9-10,17,19,28H,6,8,11-12H2,1-2H3,(H,24,27)(H,25,29);1H3,(H,3,4)/p-1