2-[(2S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium

Systemtic Name: 2-[(2S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxidanylidene-pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium Openeye Name: allyl-[2-[(2S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-pyrrolidin-2-yl]ethyl]ammonium CAS Name: 2-[(2S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxo-2-pyrrolidinyl]ethyl-prop-2-enylammonium IUPAC Name: 2-[(2S)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-oxopyrrolidin-2-yl]ethyl-prop-2-enylazanium Traditional Name: allyl-[2-[(2S)-1-homoveratryl-5-keto-pyrrolidin-2-yl]ethyl]ammonium Formula: C19H29N2O3+ MolecularWeight: 333.44516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(CCC2=O)CC[NH2+]CC=C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2[C@@H](CCC2=O)CC[NH2+]CC=C)OC

InChI

InChI=1S/C19H28N2O3/c1-4-11-20-12-9-16-6-8-19(22)21(16)13-10-15-5-7-17(23-2)18(14-15)24-3/h4-5,7,14,16,20H,1,6,8-13H2,2-3H3/p+1/t16-/m0/s1