2-azanylbutanedioic acid; 2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one

Systemtic Name: 2-azanylbutanedioic acid; 2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one Openeye Name: 2-aminobutanedioic acid; 2-(2-chlorophenyl)-2-(methylamino)cyclohexanone CAS Name: 2-aminobutanedioic acid; 2-(2-chlorophenyl)-2-(methylamino)-1-cyclohexanone IUPAC Name: 2-aminobutanedioic acid; 2-(2-chlorophenyl)-2-(methylamino)cyclohexan-1-one Traditional Name: 2-aminosuccinic acid; 2-(2-chlorophenyl)-2-(methylamino)cyclohexanone Formula: C17H23ClN2O5 MolecularWeight: 370.82792

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Descriptors Computed from Structure

Canonical SMILES:

CNC1(CCCCC1=O)C2=CC=CC=C2Cl.C(C(C(=O)O)N)C(=O)O

Isomeric SMILES

CNC1(CCCCC1=O)C2=CC=CC=C2Cl.C(C(C(=O)O)N)C(=O)O

InChI

InChI=1S/C13H16ClNO.C4H7NO4/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14;5-2(4(8)9)1-3(6)7/h2-3,6-7,15H,4-5,8-9H2,1H3;2H,1,5H2,(H,6,7)(H,8,9)