1,3-bis(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium

Systemtic Name: 1,3-bis(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium Openeye Name: 1,3-bis(p-tolyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium CAS Name: 1,3-bis(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium IUPAC Name: 1,3-bis(4-methylphenyl)-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium Traditional Name: 1,3-bis(p-tolyl)-6,7,8,9-tetrahydro-5H-imidaz[1,2-a]azepin-4-ium Formula: C22H25N2+ MolecularWeight: 317.4473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CN(C3=[N+]2CCCCC3)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CN(C3=[N+]2CCCCC3)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H25N2/c1-17-7-11-19(12-8-17)21-16-24(20-13-9-18(2)10-14-20)22-6-4-3-5-15-23(21)22/h7-14,16H,3-6,15H2,1-2H3/q+1