[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-imidazol-1-ylpropyl)azanium

Systemtic Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Openeye Name: [3-ethoxy-4-(p-tolylmethoxy)phenyl]methyl-(3-imidazol-1-ylpropyl)ammonium CAS Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl-(3-imidazol-1-ylpropyl)azanium Traditional Name: [3-ethoxy-4-(4-methylbenzyl)oxy-benzyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]CCCN2C=CN=C2)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C23H29N3O2/c1-3-27-23-15-21(16-24-11-4-13-26-14-12-25-18-26)9-10-22(23)28-17-20-7-5-19(2)6-8-20/h5-10,12,14-15,18,24H,3-4,11,13,16-17H2,1-2H3/p+1