(3S)-1-(2-chloranyl-4-methyl-phenyl)-2-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-(2-chloranyl-4-methyl-phenyl)-2-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-(2-chloro-4-methyl-phenyl)-2-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-(2-chloro-4-methylphenyl)-2-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-(2-chloro-4-methylphenyl)-2-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-(2-chloro-4-methyl-phenyl)-2-keto-pyrrolidine-3-carboxylate Formula: C12H11ClNO3- MolecularWeight: 252.67364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCC(C2=O)C(=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N2CC[C@@H](C2=O)C(=O)[O-])Cl

InChI

InChI=1S/C12H12ClNO3/c1-7-2-3-10(9(13)6-7)14-5-4-8(11(14)15)12(16)17/h2-3,6,8H,4-5H2,1H3,(H,16,17)/p-1/t8-/m0/s1