2-[4-(2-methylpropanoylamino)piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-[4-(2-methylpropanoylamino)piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-(2-methylpropanoylamino)-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[(2-methyl-1-oxopropyl)amino]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-(2-methylpropanoylamino)piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-(isobutyrylamino)piperidino]ethyl ester Formula: C19H28ClN3O4 MolecularWeight: 397.89632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

Isomeric SMILES

CC(C)C(=O)NC1CCN(CC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

InChI

InChI=1S/C19H28ClN3O4/c1-12(2)18(24)22-13-4-6-23(7-5-13)8-9-27-19(25)14-10-15(20)16(21)11-17(14)26-3/h10-13H,4-9,21H2,1-3H3,(H,22,24)