6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene

Systemtic Name: 6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene Openeye Name: 6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene CAS Name: 6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene IUPAC Name: 6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene Traditional Name: 6-(7-methoxy-3,4,5,6-tetrahydro-2H-azepin-2-yl)-2-phenyl-5-oxa-1-azoniabicyclo[2.1.1]hex-1-ene Formula: C17H21N2O2+ MolecularWeight: 285.36084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(CCCC1)C2C3CC(=[N+]2O3)C4=CC=CC=C4

Isomeric SMILES

COC1=NC(CCCC1)C2C3CC(=[N+]2O3)C4=CC=CC=C4

InChI

InChI=1S/C17H21N2O2/c1-20-16-10-6-5-9-13(18-16)17-15-11-14(19(17)21-15)12-7-3-2-4-8-12/h2-4,7-8,13,15,17H,5-6,9-11H2,1H3/q+1