3-azanyl-1-(2-cycloheptyl-2-oxidanylidene-ethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 3-azanyl-1-(2-cycloheptyl-2-oxidanylidene-ethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-(2-cycloheptyl-2-oxo-ethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-(2-cycloheptyl-2-oxoethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-(2-cycloheptyl-2-oxoethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-(2-cycloheptyl-2-keto-ethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C(N=C2C)N)CC(=O)C3CCCCCC3

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C(N=C2C)N)CC(=O)C3CCCCCC3

InChI

InChI=1S/C20H27N3O2/c1-13-8-7-11-16-14(2)22-19(21)20(25)23(18(13)16)12-17(24)15-9-5-3-4-6-10-15/h7-8,11,15,19H,3-6,9-10,12,21H2,1-2H3