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

Systemtic Name: 3-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methyl-piperidin-1-yl]propanoic acid Openeye Name: 3-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-1-piperidyl]propanoic acid CAS Name: 3-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methyl-1-piperidinyl]propanoic acid IUPAC Name: 3-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methylpiperidin-1-yl]propanoic acid Traditional Name: 3-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methyl-piperidino]propionic acid Formula: C17H24ClN3O4 MolecularWeight: 369.84316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClN3O4/c1-10-9-21(6-4-16(22)23)5-3-14(10)20-17(24)11-7-12(18)13(19)8-15(11)25-2/h7-8,10,14H,3-6,9,19H2,1-2H3,(H,20,24)(H,22,23)