1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-oxidanylidene-pyrrolidin-3-yl]azanium

Systemtic Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-oxidanylidene-pyrrolidin-3-yl]azanium Openeye Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-oxo-pyrrolidin-3-yl]ammonium CAS Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-oxo-3-pyrrolidinyl]ammonium IUPAC Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-oxopyrrolidin-3-yl]azanium Traditional Name: 1,3-benzodioxol-4-ylmethyl-[(3S)-1-cycloheptyl-5-keto-pyrrolidin-3-yl]ammonium Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2CC(CC2=O)[NH2+]CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)N2C[C@H](CC2=O)[NH2+]CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C19H26N2O3/c22-18-10-15(12-21(18)16-7-3-1-2-4-8-16)20-11-14-6-5-9-17-19(14)24-13-23-17/h5-6,9,15-16,20H,1-4,7-8,10-13H2/p+1/t15-/m0/s1