1,3-benzodioxol-5-ylmethyl-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethyl]-cyclopentyl-azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethyl]-cyclopentyl-azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxo-ethyl]-cyclopentyl-ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(1-cyclohexenyl)ethylamino]-2-oxoethyl]-cyclopentylammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethyl]-cyclopentylazanium Traditional Name: [2-[2-(cyclohexen-1-yl)ethylamino]-2-keto-ethyl]-cyclopentyl-piperonyl-ammonium Formula: C23H33N2O3+ MolecularWeight: 385.51972

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC(=O)C[NH+](CC2=CC3=C(C=C2)OCO3)C4CCCC4

Isomeric SMILES

C1CCC(=CC1)CCNC(=O)C[NH+](CC2=CC3=C(C=C2)OCO3)C4CCCC4

InChI

InChI=1S/C23H32N2O3/c26-23(24-13-12-18-6-2-1-3-7-18)16-25(20-8-4-5-9-20)15-19-10-11-21-22(14-19)28-17-27-21/h6,10-11,14,20H,1-5,7-9,12-13,15-17H2,(H,24,26)/p+1