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

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-propoxyphenyl)prop-2-enoate Openeye Name: [3-(butylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(4-propoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-propoxyphenyl)-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-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-propoxyphenyl)acrylic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C26H27NO6 MolecularWeight: 449.49568

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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)OCCC)OC1=O

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO6/c1-3-5-14-27-25(29)22-16-19-9-12-21(17-23(19)33-26(22)30)32-24(28)13-8-18-6-10-20(11-7-18)31-15-4-2/h6-13,16-17H,3-5,14-15H2,1-2H3,(H,27,29)/b13-8+