methyl 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methyl-piperidin-1-yl]hexanoate

Systemtic Name: methyl 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methyl-piperidin-1-yl]hexanoate Openeye Name: methyl 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-1-piperidyl]hexanoate CAS Name: 6-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-piperidinyl]hexanoic acid methyl ester IUPAC Name: methyl 6-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methylpiperidin-1-yl]hexanoate Traditional Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-piperidino]hexanoic acid methyl ester Formula: C21H32ClN3O4 MolecularWeight: 425.94948

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCC(=O)OC

Isomeric SMILES

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCC(=O)OC

InChI

InChI=1S/C21H32ClN3O4/c1-14-13-25(9-6-4-5-7-20(26)29-3)10-8-18(14)24-21(27)15-11-16(22)17(23)12-19(15)28-2/h11-12,14,18H,4-10,13,23H2,1-3H3,(H,24,27)