[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (E)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] (E)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] (E)-3-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]-2-propenoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] (E)-3-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]acrylic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C27H22N4O6 MolecularWeight: 498.48678

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC(=O)COC(=O)C=CC1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

Isomeric SMILES

C=CCNC(=O)NC(=O)COC(=O)/C=C/C1=CN(N=C1C2=CC3=CC=CC=C3OC2=O)C4=CC=CC=C4

InChI

InChI=1S/C27H22N4O6/c1-2-14-28-27(35)29-23(32)17-36-24(33)13-12-19-16-31(20-9-4-3-5-10-20)30-25(19)21-15-18-8-6-7-11-22(18)37-26(21)34/h2-13,15-16H,1,14,17H2,(H2,28,29,32,35)/b13-12+