methyl (2R)-2-[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2R)-2-[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyethanoylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[2-[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxyacetyl]amino]-4-methyl-pentanoate CAS Name: (2R)-2-[[2-[(Z)-2-acetamido-1-oxo-3-phenylprop-2-enoxy]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-[(Z)-2-acetamido-3-phenylprop-2-enoyl]oxyacetyl]amino]-4-methylpentanoate Traditional Name: (2R)-2-[[2-[(Z)-2-acetamido-3-phenyl-acryloyl]oxyacetyl]amino]-4-methyl-valeric acid methyl ester Formula: C20H26N2O6 MolecularWeight: 390.43024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)COC(=O)C(=CC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O6/c1-13(2)10-16(19(25)27-4)22-18(24)12-28-20(26)17(21-14(3)23)11-15-8-6-5-7-9-15/h5-9,11,13,16H,10,12H2,1-4H3,(H,21,23)(H,22,24)/b17-11-/t16-/m1/s1