4-(7-chloranyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzaldehyde

Systemtic Name: 4-(7-chloranyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-5-yl)benzaldehyde Openeye Name: 4-(7-chloro-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzaldehyde CAS Name: 4-(7-chloro-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzaldehyde IUPAC Name: 4-(7-chloro-1-methyl-2-oxo-3H-1,4-benzodiazepin-5-yl)benzaldehyde Traditional Name: 4-(7-chloro-2-keto-1-methyl-3H-1,4-benzodiazepin-5-yl)benzaldehyde Formula: C17H13ClN2O2 MolecularWeight: 312.75032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)C=O

Isomeric SMILES

CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C17H13ClN2O2/c1-20-15-7-6-13(18)8-14(15)17(19-9-16(20)22)12-4-2-11(10-21)3-5-12/h2-8,10H,9H2,1H3