10-chloranyl-6-oxidanylidene-11b-phenyl-2,3,5,7-tetrahydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid

Systemtic Name: 10-chloranyl-6-oxidanylidene-11b-phenyl-2,3,5,7-tetrahydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid Openeye Name: 10-chloro-6-oxo-11b-phenyl-2,3,5,7-tetrahydrooxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid CAS Name: 10-chloro-6-oxo-11b-phenyl-2,3,5,7-tetrahydrooxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid IUPAC Name: 10-chloro-6-oxo-11b-phenyl-2,3,5,7-tetrahydro-[1,3]oxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid Traditional Name: 10-chloro-6-keto-11b-phenyl-2,3,5,7-tetrahydrooxazolo[3,2-d][1,4]benzodiazepine-5-carboxylic acid Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2(N1C(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1COC2(N1C(C(=O)NC3=C2C=C(C=C3)Cl)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C18H15ClN2O4/c19-12-6-7-14-13(10-12)18(11-4-2-1-3-5-11)21(8-9-25-18)15(17(23)24)16(22)20-14/h1-7,10,15H,8-9H2,(H,20,22)(H,23,24)