4-azanyl-5-chloranyl-2-methoxy-N-[1-(phenylmethyl)piperidin-4-yl]benzamide hydrate hydrochloride

Systemtic Name: 4-azanyl-5-chloranyl-2-methoxy-N-[1-(phenylmethyl)piperidin-4-yl]benzamide hydrate hydrochloride Openeye Name: 4-amino-N-(1-benzyl-4-piperidyl)-5-chloro-2-methoxy-benzamide hydrate hydrochloride CAS Name: 4-amino-5-chloro-2-methoxy-N-[1-(phenylmethyl)-4-piperidinyl]benzamide hydrate hydrochloride IUPAC Name: 4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide hydrate hydrochloride Traditional Name: 4-amino-N-(1-benzyl-4-piperidyl)-5-chloro-2-methoxy-benzamide hydrate hydrochloride Formula: C20H27Cl2N3O3 MolecularWeight: 428.35268

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N.O.Cl

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N.O.Cl

InChI

InChI=1S/C20H24ClN3O2.ClH.H2O/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14;;/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25);1H;1H2