4-[3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]pyrrolidin-1-yl]butanoic acid

Systemtic Name: 4-[3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]pyrrolidin-1-yl]butanoic acid Openeye Name: 4-[3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]pyrrolidin-1-yl]butanoic acid CAS Name: 4-[3-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-1-pyrrolidinyl]butanoic acid IUPAC Name: 4-[3-[(4-amino-5-chloro-2-methoxybenzoyl)amino]pyrrolidin-1-yl]butanoic acid Traditional Name: 4-[3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]pyrrolidino]butyric acid Formula: C16H22ClN3O4 MolecularWeight: 355.81658

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NC2CCN(C2)CCCC(=O)O)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NC2CCN(C2)CCCC(=O)O)Cl)N

InChI

InChI=1S/C16H22ClN3O4/c1-24-14-8-13(18)12(17)7-11(14)16(23)19-10-4-6-20(9-10)5-2-3-15(21)22/h7-8,10H,2-6,9,18H2,1H3,(H,19,23)(H,21,22)