[2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxidanylidene-ethyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: [2-[[(1S)-1-methylpropyl]carbamoylamino]-2-oxo-ethyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (Z)-2-acetamido-3-phenyl-2-propenoic acid [2-[[[[(2S)-butan-2-yl]amino]-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2S)-butan-2-yl]carbamoylamino]-2-oxoethyl] (Z)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (Z)-2-acetamido-3-phenyl-acrylic acid [2-keto-2-[[(1S)-1-methylpropyl]carbamoylamino]ethyl] ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O5/c1-4-12(2)19-18(25)21-16(23)11-26-17(24)15(20-13(3)22)10-14-8-6-5-7-9-14/h5-10,12H,4,11H2,1-3H3,(H,20,22)(H2,19,21,23,25)/b15-10-/t12-/m0/s1