[(2R)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [(2R)-1-(cyclopentylamino)-1-oxidanylidene-propan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(1R)-2-(cyclopentylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: [(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(1R)-2-(cyclopentylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCC1)[NH+](C)CC2=CC=C(C=C2)OCC=C

Isomeric SMILES

C[C@H](C(=O)NC1CCCC1)[NH+](C)CC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C19H28N2O2/c1-4-13-23-18-11-9-16(10-12-18)14-21(3)15(2)19(22)20-17-7-5-6-8-17/h4,9-12,15,17H,1,5-8,13-14H2,2-3H3,(H,20,22)/p+1/t15-/m1/s1