[3-(furan-2-ylmethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-butoxyphenyl)prop-2-enoate

Systemtic Name: [3-(furan-2-ylmethylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-butoxyphenyl)prop-2-enoate Openeye Name: [3-(2-furylmethylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(4-butoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-butoxyphenyl)-2-propenoic acid [3-[(2-furanylmethylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(furan-2-ylmethylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(4-butoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-butoxyphenyl)acrylic acid [3-(2-furfurylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C28H25NO7 MolecularWeight: 487.5006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C28H25NO7/c1-2-3-14-33-21-10-6-19(7-11-21)8-13-26(30)35-22-12-9-20-16-24(28(32)36-25(20)17-22)27(31)29-18-23-5-4-15-34-23/h4-13,15-17H,2-3,14,18H2,1H3,(H,29,31)/b13-8+