2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium

Systemtic Name: 2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium Openeye Name: 2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium CAS Name: 2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium IUPAC Name: 2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium Traditional Name: 2-phenyl-4,5,6,7-tetrahydro-1H-1,3-diazepin-3-ium Formula: C11H15N2+ MolecularWeight: 175.2502

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+]=C(NC1)C2=CC=CC=C2

Isomeric SMILES

C1CC[NH+]=C(NC1)C2=CC=CC=C2

InChI

InChI=1S/C11H14N2/c1-2-6-10(7-3-1)11-12-8-4-5-9-13-11/h1-3,6-7H,4-5,8-9H2,(H,12,13)/p+1