1,3-benzodioxol-4-ylmethyl-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-indan-2-yl-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-(2,3-dihydro-1H-inden-2-yl)-5-oxopyrrolidin-3-yl]azanium Traditional Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-indan-2-yl-5-keto-pyrrolidin-3-yl]ammonium Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=CC=CC=C21)N3CC(CC3=O)[NH2+]CC4=C5C(=CC=C4)OCO5

Isomeric SMILES

C1[C@@H](CN(C1=O)C2CC3=CC=CC=C3C2)[NH2+]CC4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C21H22N2O3/c24-20-10-17(22-11-16-6-3-7-19-21(16)26-13-25-19)12-23(20)18-8-14-4-1-2-5-15(14)9-18/h1-7,17-18,22H,8-13H2/p+1/t17-/m0/s1