2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one

Systemtic Name: 2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one Openeye Name: 2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one CAS Name: 2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one IUPAC Name: 2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one Traditional Name: 2-cyclohexyl-4-methyl-2,3-dihydro-1H-2,4-benzodiazepin-2-ium-5-one Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

CN1C[NH+](CC2=CC=CC=C2C1=O)C3CCCCC3

Isomeric SMILES

CN1C[NH+](CC2=CC=CC=C2C1=O)C3CCCCC3

InChI

InChI=1S/C16H22N2O/c1-17-12-18(14-8-3-2-4-9-14)11-13-7-5-6-10-15(13)16(17)19/h5-7,10,14H,2-4,8-9,11-12H2,1H3/p+1