2,4-dimethyl-3H-1,5-benzodiazepin-1-ium

Systemtic Name: 2,4-dimethyl-3H-1,5-benzodiazepin-1-ium Openeye Name: 2,4-dimethyl-3H-1,5-benzodiazepin-1-ium CAS Name: 2,4-dimethyl-3H-1,5-benzodiazepin-1-ium IUPAC Name: 2,4-dimethyl-3H-1,5-benzodiazepin-1-ium Traditional Name: 2,4-dimethyl-3H-1,5-benzodiazepin-1-ium Formula: C11H13N2+ MolecularWeight: 173.23432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2/c1-8-7-9(2)13-11-6-4-3-5-10(11)12-8/h3-6H,7H2,1-2H3/p+1