2-[8-chloranyl-5-(3-hydroxyphenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethanoic acid

Systemtic Name: 2-[8-chloranyl-5-(3-hydroxyphenyl)-2-oxidanylidene-3H-1,4-benzodiazepin-1-yl]ethanoic acid Openeye Name: 2-[8-chloro-5-(3-hydroxyphenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]acetic acid CAS Name: 2-[8-chloro-5-(3-hydroxyphenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]acetic acid IUPAC Name: 2-[8-chloro-5-(3-hydroxyphenyl)-2-oxo-3H-1,4-benzodiazepin-1-yl]acetic acid Traditional Name: 2-[8-chloro-5-(3-hydroxyphenyl)-2-keto-3H-1,4-benzodiazepin-1-yl]acetic acid Formula: C17H13ClN2O4 MolecularWeight: 344.74912

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=CC(=C2)Cl)C(=N1)C3=CC(=CC=C3)O)CC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(C=CC(=C2)Cl)C(=N1)C3=CC(=CC=C3)O)CC(=O)O

InChI

InChI=1S/C17H13ClN2O4/c18-11-4-5-13-14(7-11)20(9-16(23)24)15(22)8-19-17(13)10-2-1-3-12(21)6-10/h1-7,21H,8-9H2,(H,23,24)