piperidin-1-yl 4-azanyl-3-chloranyl-5-methoxy-1-[(2-methoxyphenyl)carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: piperidin-1-yl 4-azanyl-3-chloranyl-5-methoxy-1-[(2-methoxyphenyl)carbonylamino]cyclohexane-1-carboxylate Openeye Name: 1-piperidyl 4-amino-3-chloro-5-methoxy-1-[(2-methoxybenzoyl)amino]cyclohexanecarboxylate CAS Name: 4-amino-3-chloro-5-methoxy-1-[[(2-methoxyphenyl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid 1-piperidinyl ester IUPAC Name: piperidin-1-yl 4-amino-3-chloro-5-methoxy-1-[(2-methoxybenzoyl)amino]cyclohexane-1-carboxylate Traditional Name: 4-amino-3-chloro-5-methoxy-1-(o-anisoylamino)cyclohexanecarboxylic acid piperidino ester Formula: C21H30ClN3O5 MolecularWeight: 439.933

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(CC(C1N)Cl)(C(=O)ON2CCCCC2)NC(=O)C3=CC=CC=C3OC

Isomeric SMILES

COC1CC(CC(C1N)Cl)(C(=O)ON2CCCCC2)NC(=O)C3=CC=CC=C3OC

InChI

InChI=1S/C21H30ClN3O5/c1-28-16-9-5-4-8-14(16)19(26)24-21(12-15(22)18(23)17(13-21)29-2)20(27)30-25-10-6-3-7-11-25/h4-5,8-9,15,17-18H,3,6-7,10-13,23H2,1-2H3,(H,24,26)