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

Systemtic Name: 2-[4-[(2-cyclohexylethanoylamino)methyl]piperidin-1-yl]ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-[4-[[(2-cyclohexylacetyl)amino]methyl]-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-[4-[[(2-cyclohexyl-1-oxoethyl)amino]methyl]-1-piperidinyl]ethyl ester IUPAC Name: 2-[4-[[(2-cyclohexylacetyl)amino]methyl]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-[4-[[(2-cyclohexylacetyl)amino]methyl]piperidino]ethyl ester Formula: C24H36ClN3O4 MolecularWeight: 466.01334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)CC3CCCCC3)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OCCN2CCC(CC2)CNC(=O)CC3CCCCC3)Cl)N

InChI

InChI=1S/C24H36ClN3O4/c1-31-22-15-21(26)20(25)14-19(22)24(30)32-12-11-28-9-7-18(8-10-28)16-27-23(29)13-17-5-3-2-4-6-17/h14-15,17-18H,2-13,16,26H2,1H3,(H,27,29)