2-[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepin-8-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepin-8-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepine-8-carbonyl]amino]acetic acid CAS Name: 2-[[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepin-8-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepine-8-carbonyl]amino]acetic acid Traditional Name: 2-[[6-(2-chlorophenyl)-1-methyl-4H-imidazo[1,2-a][1,4]benzodiazepine-8-carbonyl]amino]acetic acid Formula: C21H17ClN4O3 MolecularWeight: 408.83768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2N1C3=C(C=C(C=C3)C(=O)NCC(=O)O)C(=NC2)C4=CC=CC=C4Cl

Isomeric SMILES

CC1=CN=C2N1C3=C(C=C(C=C3)C(=O)NCC(=O)O)C(=NC2)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H17ClN4O3/c1-12-9-23-18-10-24-20(14-4-2-3-5-16(14)22)15-8-13(6-7-17(15)26(12)18)21(29)25-11-19(27)28/h2-9H,10-11H2,1H3,(H,25,29)(H,27,28)