4-[(4-methoxyphenyl)methyl]-N-phenyl-1,4-diazepan-4-ium-1-carboxamide

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-N-phenyl-1,4-diazepan-4-ium-1-carboxamide Openeye Name: 4-[(4-methoxyphenyl)methyl]-N-phenyl-1,4-diazepan-4-ium-1-carboxamide CAS Name: 4-[(4-methoxyphenyl)methyl]-N-phenyl-1,4-diazepan-4-ium-1-carboxamide IUPAC Name: 4-[(4-methoxyphenyl)methyl]-N-phenyl-1,4-diazepan-4-ium-1-carboxamide Traditional Name: 4-p-anisyl-N-phenyl-1,4-diazepan-4-ium-1-carboxamide Formula: C20H26N3O2+ MolecularWeight: 340.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCCN(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCCN(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O2/c1-25-19-10-8-17(9-11-19)16-22-12-5-13-23(15-14-22)20(24)21-18-6-3-2-4-7-18/h2-4,6-11H,5,12-16H2,1H3,(H,21,24)/p+1