2-[(2S)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium

Systemtic Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidin-2-yl]ethyl-prop-2-enyl-azanium Openeye Name: allyl-[2-[(2S)-5-oxo-1-(p-tolylmethyl)pyrrolidin-2-yl]ethyl]ammonium CAS Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-5-oxo-2-pyrrolidinyl]ethyl-prop-2-enylammonium IUPAC Name: 2-[(2S)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidin-2-yl]ethyl-prop-2-enylazanium Traditional Name: allyl-[2-[(2S)-5-keto-1-(4-methylbenzyl)pyrrolidin-2-yl]ethyl]ammonium Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(CCC2=O)CC[NH2+]CC=C

Isomeric SMILES

CC1=CC=C(C=C1)CN2[C@@H](CCC2=O)CC[NH2+]CC=C

InChI

InChI=1S/C17H24N2O/c1-3-11-18-12-10-16-8-9-17(20)19(16)13-15-6-4-14(2)5-7-15/h3-7,16,18H,1,8-13H2,2H3/p+1/t16-/m0/s1