[(3S)-1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(3S)-1-[2-(4-methoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(3S)-1-[2-(4-methoxyphenyl)ethyl]-5-oxo-pyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(3S)-1-[2-(4-methoxyphenyl)ethyl]-5-oxo-3-pyrrolidinyl]-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(3S)-1-[2-(4-methoxyphenyl)ethyl]-5-oxopyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(3S)-5-keto-1-[2-(4-methoxyphenyl)ethyl]pyrrolidin-3-yl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C19H31N3O2+2 MolecularWeight: 333.46834

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]C2CC(=O)N(C2)CCC3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+][C@H]2CC(=O)N(C2)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C19H29N3O2/c1-21-10-8-16(9-11-21)20-17-13-19(23)22(14-17)12-7-15-3-5-18(24-2)6-4-15/h3-6,16-17,20H,7-14H2,1-2H3/p+2/t17-/m0/s1