1,3-benzodioxol-5-ylmethyl-[(3S)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(3S)-2,5-bis(oxidanylidene)-1-phenyl-pyrrolidin-3-yl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(3S)-2,5-dioxo-1-phenyl-pyrrolidin-3-yl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(3S)-2,5-dioxo-1-phenyl-3-pyrrolidinyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(3S)-2,5-dioxo-1-phenylpyrrolidin-3-yl]azanium Traditional Name: [(3S)-2,5-diketo-1-phenyl-pyrrolidin-3-yl]-piperonyl-ammonium Formula: C18H17N2O4+ MolecularWeight: 325.33858

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=CC=C2)[NH2+]CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1[C@@H](C(=O)N(C1=O)C2=CC=CC=C2)[NH2+]CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H16N2O4/c21-17-9-14(18(22)20(17)13-4-2-1-3-5-13)19-10-12-6-7-15-16(8-12)24-11-23-15/h1-8,14,19H,9-11H2/p+1/t14-/m0/s1