7-chloranyl-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid

Systemtic Name: 7-chloranyl-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid Openeye Name: 7-chloro-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid CAS Name: 7-chloro-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid IUPAC Name: 7-chloro-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid Traditional Name: 7-chloro-4-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine-2-carboxylic acid Formula: C16H15ClN2O2 MolecularWeight: 302.7555

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC2=C(CN1C3=CC=CC=C3)C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1C(NC2=C(CN1C3=CC=CC=C3)C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C16H15ClN2O2/c17-12-6-7-14-11(8-12)9-19(10-15(18-14)16(20)21)13-4-2-1-3-5-13/h1-8,15,18H,9-10H2,(H,20,21)