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

Systemtic Name: 1-oxidanidyl-4-phenyl-2,3,5,6-tetrahydro-1,4-diazepin-1-ium Openeye Name: 1-oxido-4-phenyl-2,3,5,6-tetrahydro-1,4-diazepin-1-ium CAS Name: 1-oxido-4-phenyl-2,3,5,6-tetrahydro-1,4-diazepin-1-ium IUPAC Name: 1-oxido-4-phenyl-2,3,5,6-tetrahydro-1,4-diazepin-1-ium Traditional Name: 1-oxido-4-phenyl-2,3,5,6-tetrahydro-1,4-diazepin-1-ium Formula: C11H14N2O MolecularWeight: 190.24166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[N+](=C1)[O-])C2=CC=CC=C2

Isomeric SMILES

C1CN(CC[N+](=C1)[O-])C2=CC=CC=C2

InChI

InChI=1S/C11H14N2O/c14-13-8-4-7-12(9-10-13)11-5-2-1-3-6-11/h1-3,5-6,8H,4,7,9-10H2