methyl 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]hexanoate hydrochloride

Systemtic Name: methyl 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]hexanoate hydrochloride Openeye Name: methyl 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-1-piperidyl]hexanoate hydrochloride CAS Name: 6-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-piperidinyl]hexanoic acid methyl ester hydrochloride IUPAC Name: methyl 6-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]hexanoate hydrochloride Traditional Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]piperidino]hexanoic acid methyl ester hydrochloride Formula: C20H31Cl2N3O4 MolecularWeight: 448.38384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCCCCC(=O)OC)Cl)N.Cl

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCCCCC(=O)OC)Cl)N.Cl

InChI

InChI=1S/C20H30ClN3O4.ClH/c1-27-18-13-17(22)16(21)12-15(18)20(26)23-14-7-10-24(11-8-14)9-5-3-4-6-19(25)28-2;/h12-14H,3-11,22H2,1-2H3,(H,23,26);1H