[(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: [(1S)-2-(ethylcarbamoylamino)-2-oxidanylidene-1-phenyl-ethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenyl-ethyl]-methyl-ammonium CAS Name: [(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: [(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl]-methyl-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[(1S)-2-(ethylcarbamoylamino)-2-keto-1-phenyl-ethyl]-methyl-ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)OCC=C

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C1=CC=CC=C1)[NH+](C)CC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C22H27N3O3/c1-4-15-28-19-13-11-17(12-14-19)16-25(3)20(18-9-7-6-8-10-18)21(26)24-22(27)23-5-2/h4,6-14,20H,1,5,15-16H2,2-3H3,(H2,23,24,26,27)/p+1/t20-/m0/s1