[4-(azepan-1-yl)phenyl]methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium

Systemtic Name: [4-(azepan-1-yl)phenyl]methyl-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium Openeye Name: [4-(azepan-1-yl)phenyl]methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]ammonium CAS Name: [4-(1-azepanyl)phenyl]methyl-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: [4-(azepan-1-yl)phenyl]methyl-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]azanium Traditional Name: [4-(azepan-1-yl)benzyl]-[4-(2-ketopyrrolidino)benzyl]ammonium Formula: C24H32N3O+ MolecularWeight: 378.53038

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)C[NH2+]CC3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)C[NH2+]CC3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C24H31N3O/c28-24-6-5-17-27(24)23-13-9-21(10-14-23)19-25-18-20-7-11-22(12-8-20)26-15-3-1-2-4-16-26/h7-14,25H,1-6,15-19H2/p+1