[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [2-[(1-cyanocyclopentyl)amino]-2-oxoethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CC(=O)NC2(CCCC2)C#N

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C19H25N3O2/c1-3-12-24-17-8-6-16(7-9-17)13-22(2)14-18(23)21-19(15-20)10-4-5-11-19/h3,6-9H,1,4-5,10-14H2,2H3,(H,21,23)/p+1