6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]hexanoic acid

Systemtic Name: 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]piperidin-1-yl]hexanoic acid Openeye Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-1-piperidyl]hexanoic acid CAS Name: 6-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-piperidinyl]hexanoic acid IUPAC Name: 6-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]piperidin-1-yl]hexanoic acid Traditional Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]piperidino]hexanoic acid Formula: C19H28ClN3O4 MolecularWeight: 397.89632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCCCCC(=O)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CCCCCC(=O)O)Cl)N

InChI

InChI=1S/C19H28ClN3O4/c1-27-17-12-16(21)15(20)11-14(17)19(26)22-13-6-9-23(10-7-13)8-4-2-3-5-18(24)25/h11-13H,2-10,21H2,1H3,(H,22,26)(H,24,25)