7-chloranyl-1-(2-oxidanylidenepropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-1-(2-oxidanylidenepropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-acetonyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-1-(2-oxopropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-1-(2-oxopropyl)-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-acetonyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C18H15ClN2O2 MolecularWeight: 326.7769

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O2/c1-12(22)11-21-16-8-7-14(19)9-15(16)18(20-10-17(21)23)13-5-3-2-4-6-13/h2-9H,10-11H2,1H3