[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] (E)-3-(3-phenoxyphenyl)prop-2-enoate

Systemtic Name: [2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethyl] (E)-3-(3-phenoxyphenyl)prop-2-enoate Openeye Name: [2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethyl] (E)-3-(3-phenoxyphenyl)prop-2-enoate CAS Name: (E)-3-(3-phenoxyphenyl)-2-propenoic acid [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]amino]-2-oxoethyl] (E)-3-(3-phenoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-phenoxyphenyl)acrylic acid [2-keto-2-[[(1S)-1-methylpropyl]amino]ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C=CC1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC[C@H](C)NC(=O)COC(=O)/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C21H23NO4/c1-3-16(2)22-20(23)15-25-21(24)13-12-17-8-7-11-19(14-17)26-18-9-5-4-6-10-18/h4-14,16H,3,15H2,1-2H3,(H,22,23)/b13-12+/t16-/m0/s1