1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one

Systemtic Name: 1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one Openeye Name: 1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one CAS Name: 1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one IUPAC Name: 1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one Traditional Name: 1,4,5-trimethyl-3H-1,5-benzodiazepin-5-ium-2-one Formula: C12H15N2O+ MolecularWeight: 203.2603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N(C(=O)C1)C)C

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N(C(=O)C1)C)C

InChI

InChI=1S/C12H15N2O/c1-9-8-12(15)14(3)11-7-5-4-6-10(11)13(9)2/h4-7H,8H2,1-3H3/q+1