1-[2-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]ethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[4-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]-3-methoxy-piperidin-1-yl]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-1-piperidyl]acetyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[4-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-3-methoxy-1-piperidinyl]-1-oxoethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[4-[(4-amino-5-chloro-2-methoxybenzoyl)amino]-3-methoxypiperidin-1-yl]acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[4-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]-3-methoxy-piperidino]acetyl]isonipecotic acid Formula: C22H31ClN4O6 MolecularWeight: 482.95774

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CC(=O)N3CCC(CC3)C(=O)O

Isomeric SMILES

COC1CN(CCC1NC(=O)C2=CC(=C(C=C2OC)N)Cl)CC(=O)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C22H31ClN4O6/c1-32-18-10-16(24)15(23)9-14(18)21(29)25-17-5-6-26(11-19(17)33-2)12-20(28)27-7-3-13(4-8-27)22(30)31/h9-10,13,17,19H,3-8,11-12,24H2,1-2H3,(H,25,29)(H,30,31)