N-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide

Systemtic Name: N-(7-chloranyl-2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Openeye Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide CAS Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide IUPAC Name: N-(7-chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Traditional Name: N-(7-chloro-2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Formula: C22H22ClN3O2 MolecularWeight: 395.88198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2C(=O)NC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H22ClN3O2/c23-16-11-12-18-17(13-16)19(14-7-3-1-4-8-14)25-20(22(28)24-18)26-21(27)15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,20H,2,5-6,9-10H2,(H,24,28)(H,26,27)