6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methyl-piperidin-1-yl]hexanoic acid

Systemtic Name: 6-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methyl-piperidin-1-yl]hexanoic acid Openeye Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-1-piperidyl]hexanoic acid CAS Name: 6-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-piperidinyl]hexanoic acid IUPAC Name: 6-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methylpiperidin-1-yl]hexanoic acid Traditional Name: 6-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-piperidino]hexanoic acid Formula: C20H30ClN3O4 MolecularWeight: 411.9229

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCC(=O)O

Isomeric SMILES

CC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CCCCCC(=O)O

InChI

InChI=1S/C20H30ClN3O4/c1-13-12-24(8-5-3-4-6-19(25)26)9-7-17(13)23-20(27)14-10-15(21)16(22)11-18(14)28-2/h10-11,13,17H,3-9,12,22H2,1-2H3,(H,23,27)(H,25,26)