[4-(azepan-1-yl)phenyl]methyl-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: [4-(azepan-1-yl)phenyl]methyl-[(4-methoxyphenyl)methyl]azanium Openeye Name: [4-(azepan-1-yl)phenyl]methyl-[(4-methoxyphenyl)methyl]ammonium CAS Name: [4-(1-azepanyl)phenyl]methyl-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: [4-(azepan-1-yl)phenyl]methyl-[(4-methoxyphenyl)methyl]azanium Traditional Name: [4-(azepan-1-yl)benzyl]-p-anisyl-ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH2+]CC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH2+]CC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H28N2O/c1-24-21-12-8-19(9-13-21)17-22-16-18-6-10-20(11-7-18)23-14-4-2-3-5-15-23/h6-13,22H,2-5,14-17H2,1H3/p+1