[(3R)-1-(4-butoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium

Systemtic Name: [(3R)-1-(4-butoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium Openeye Name: [(3R)-1-(4-butoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]-[2-(3,4-dimethoxyphenyl)ethyl]ammonium CAS Name: [(3R)-1-(4-butoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]-[2-(3,4-dimethoxyphenyl)ethyl]ammonium IUPAC Name: [(3R)-1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-[2-(3,4-dimethoxyphenyl)ethyl]azanium Traditional Name: [(3R)-1-(4-butoxyphenyl)-2,5-diketo-pyrrolidin-3-yl]-homoveratryl-ammonium Formula: C24H31N2O5+ MolecularWeight: 427.51334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)[NH2+]CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N2C(=O)C[C@H](C2=O)[NH2+]CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H30N2O5/c1-4-5-14-31-19-9-7-18(8-10-19)26-23(27)16-20(24(26)28)25-13-12-17-6-11-21(29-2)22(15-17)30-3/h6-11,15,20,25H,4-5,12-14,16H2,1-3H3/p+1/t20-/m1/s1