5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid

Systemtic Name: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid Openeye Name: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid CAS Name: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid IUPAC Name: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid Traditional Name: 5,7-dimethyl-2,3-dihydro-1H-1,4-diazepine-2-carboxylic acid Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NCC(N1)C(=O)O)C

Isomeric SMILES

CC1=CC(=NCC(N1)C(=O)O)C

InChI

InChI=1S/C8H12N2O2/c1-5-3-6(2)10-7(4-9-5)8(11)12/h3,7,10H,4H2,1-2H3,(H,11,12)