[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Openeye Name: [(1S)-1-methyl-2-oxo-2-(propylamino)ethyl] (E)-3-(4-isopropylphenyl)prop-2-enoate CAS Name: (E)-3-(4-propan-2-ylphenyl)-2-propenoic acid [(2S)-1-oxo-1-(propylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(propylamino)propan-2-yl] (E)-3-(4-propan-2-ylphenyl)prop-2-enoate Traditional Name: (E)-3-p-cumenylacrylic acid [(1S)-2-keto-1-methyl-2-(propylamino)ethyl] ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)OC(=O)C=CC1=CC=C(C=C1)C(C)C

Isomeric SMILES

CCCNC(=O)[C@H](C)OC(=O)/C=C/C1=CC=C(C=C1)C(C)C

InChI

InChI=1S/C18H25NO3/c1-5-12-19-18(21)14(4)22-17(20)11-8-15-6-9-16(10-7-15)13(2)3/h6-11,13-14H,5,12H2,1-4H3,(H,19,21)/b11-8+/t14-/m0/s1