1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxidanylidene-ethyl]-3-azanyl-5,9-dimethyl-3H-1,4-benzodiazepin-2-one

Systemtic Name: 1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxidanylidene-ethyl]-3-azanyl-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxo-ethyl]-5,9-dimethyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxoethyl]-5,9-dimethyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxoethyl]-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-keto-ethyl]-5,9-dimethyl-3H-1,4-benzodiazepin-2-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N(C(=O)C(N=C2C)N)CC(=O)N3CC4CCC(C3)CC4

Isomeric SMILES

CC1=CC=CC2=C1N(C(=O)C(N=C2C)N)CC(=O)N3CC4CCC(C3)CC4

InChI

InChI=1S/C21H28N4O2/c1-13-4-3-5-17-14(2)23-20(22)21(27)25(19(13)17)12-18(26)24-10-15-6-7-16(11-24)9-8-15/h3-5,15-16,20H,6-12,22H2,1-2H3