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

Systemtic Name: 1,2-bis(4-ethoxyphenyl)-3-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium Openeye Name: 1,2-bis(4-ethoxyphenyl)-3-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium CAS Name: 1,2-bis(4-ethoxyphenyl)-3-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium IUPAC Name: 1,2-bis(4-ethoxyphenyl)-3-methyl-6,7,8,9-tetrahydro-5H-imidazo[1,2-a]azepin-4-ium Traditional Name: 3-methyl-1,2-bis(p-phenetyl)-6,7,8,9-tetrahydro-5H-imidaz[1,2-a]azepin-4-ium Formula: C25H31N2O2+ MolecularWeight: 391.52584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C([N+]3=C(N2C4=CC=C(C=C4)OCC)CCCCC3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C([N+]3=C(N2C4=CC=C(C=C4)OCC)CCCCC3)C

InChI

InChI=1S/C25H31N2O2/c1-4-28-22-14-10-20(11-15-22)25-19(3)26-18-8-6-7-9-24(26)27(25)21-12-16-23(17-13-21)29-5-2/h10-17H,4-9,18H2,1-3H3/q+1