1-tert-butyl-7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-tert-butyl-7-chloranyl-5-phenyl-3H-1,4-benzodiazepin-2-one Openeye Name: 1-tert-butyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one CAS Name: 1-tert-butyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 1-tert-butyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one Traditional Name: 1-tert-butyl-7-chloro-5-phenyl-3H-1,4-benzodiazepin-2-one Formula: C19H19ClN2O MolecularWeight: 326.81996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H19ClN2O/c1-19(2,3)22-16-10-9-14(20)11-15(16)18(21-12-17(22)23)13-7-5-4-6-8-13/h4-11H,12H2,1-3H3