[3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-ethoxyphenyl)prop-2-enoate

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-ethoxyphenyl)prop-2-enoate Openeye Name: [3-(butylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(4-ethoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-ethoxyphenyl)-2-propenoic acid [3-[butylamino(oxo)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(butylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(4-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-p-phenetylacrylic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C=CC3=CC=C(C=C3)OCC)OC1=O

Isomeric SMILES

CCCCNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)/C=C/C3=CC=C(C=C3)OCC)OC1=O

InChI

InChI=1S/C25H25NO6/c1-3-5-14-26-24(28)21-15-18-9-12-20(16-22(18)32-25(21)29)31-23(27)13-8-17-6-10-19(11-7-17)30-4-2/h6-13,15-16H,3-5,14H2,1-2H3,(H,26,28)/b13-8+