(3-azanyl-3-oxidanylidene-propyl)-[1-[3-(3-methoxyphenyl)phenyl]piperidin-4-yl]azanium

Systemtic Name: (3-azanyl-3-oxidanylidene-propyl)-[1-[3-(3-methoxyphenyl)phenyl]piperidin-4-yl]azanium Openeye Name: (3-amino-3-oxo-propyl)-[1-[3-(3-methoxyphenyl)phenyl]-4-piperidyl]ammonium CAS Name: (3-amino-3-oxopropyl)-[1-[3-(3-methoxyphenyl)phenyl]-4-piperidinyl]ammonium IUPAC Name: (3-amino-3-oxopropyl)-[1-[3-(3-methoxyphenyl)phenyl]piperidin-4-yl]azanium Traditional Name: (3-amino-3-keto-propyl)-[1-[3-(3-methoxyphenyl)phenyl]-4-piperidyl]ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=CC=C2)N3CCC(CC3)[NH2+]CCC(=O)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=CC=C2)N3CCC(CC3)[NH2+]CCC(=O)N

InChI

InChI=1S/C21H27N3O2/c1-26-20-7-3-5-17(15-20)16-4-2-6-19(14-16)24-12-9-18(10-13-24)23-11-8-21(22)25/h2-7,14-15,18,23H,8-13H2,1H3,(H2,22,25)/p+1