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

Systemtic Name: 1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxidanylidene-ethyl]-3-azanyl-5-ethyl-9-methyl-3H-1,4-benzodiazepin-2-one Openeye Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxo-ethyl]-5-ethyl-9-methyl-3H-1,4-benzodiazepin-2-one CAS Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxoethyl]-5-ethyl-9-methyl-3H-1,4-benzodiazepin-2-one IUPAC Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-oxoethyl]-5-ethyl-9-methyl-3H-1,4-benzodiazepin-2-one Traditional Name: 3-amino-1-[2-(3-azabicyclo[3.2.2]nonan-3-yl)-2-keto-ethyl]-5-ethyl-9-methyl-3H-1,4-benzodiazepin-2-one Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(C(=O)N(C2=C1C=CC=C2C)CC(=O)N3CC4CCC(C3)CC4)N

Isomeric SMILES

CCC1=NC(C(=O)N(C2=C1C=CC=C2C)CC(=O)N3CC4CCC(C3)CC4)N

InChI

InChI=1S/C22H30N4O2/c1-3-18-17-6-4-5-14(2)20(17)26(22(28)21(23)24-18)13-19(27)25-11-15-7-8-16(12-25)10-9-15/h4-6,15-16,21H,3,7-13,23H2,1-2H3