1-(2,3-dihydroindol-1-yl)-3-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]propan-1-one

Systemtic Name: 1-(2,3-dihydroindol-1-yl)-3-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]propan-1-one Openeye Name: 3-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one CAS Name: 1-(2,3-dihydroindol-1-yl)-3-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]-1-propanone IUPAC Name: 1-(2,3-dihydroindol-1-yl)-3-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]propan-1-one Traditional Name: 3-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-1-indolin-1-yl-propan-1-one Formula: C23H29N2O3+ MolecularWeight: 381.48796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC[NH+]2CCC(=O)N3CCC4=CC=CC=C43)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCC[NH+]2CCC(=O)N3CCC4=CC=CC=C43)OC

InChI

InChI=1S/C23H28N2O3/c1-27-18-9-10-19(22(16-18)28-2)21-8-5-13-24(21)14-12-23(26)25-15-11-17-6-3-4-7-20(17)25/h3-4,6-7,9-10,16,21H,5,8,11-15H2,1-2H3/p+1/t21-/m1/s1