2-[4-[[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]methyl]piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]methyl]piperidin-1-yl]ethanoic acid Openeye Name: 2-[4-[[(4-amino-5-chloro-2-methoxy-benzoyl)amino]methyl]-1-piperidyl]acetic acid CAS Name: 2-[4-[[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]methyl]-1-piperidinyl]acetic acid IUPAC Name: 2-[4-[[(4-amino-5-chloro-2-methoxybenzoyl)amino]methyl]piperidin-1-yl]acetic acid Traditional Name: 2-[4-[[(4-amino-5-chloro-2-methoxy-benzoyl)amino]methyl]piperidino]acetic acid Formula: C16H22ClN3O4 MolecularWeight: 355.81658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCC2CCN(CC2)CC(=O)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCC2CCN(CC2)CC(=O)O)Cl)N

InChI

InChI=1S/C16H22ClN3O4/c1-24-14-7-13(18)12(17)6-11(14)16(23)19-8-10-2-4-20(5-3-10)9-15(21)22/h6-7,10H,2-5,8-9,18H2,1H3,(H,19,23)(H,21,22)