[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-2-propenoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)acrylic acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C27H29NO7 MolecularWeight: 479.52166

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC(C)C)OC

InChI

InChI=1S/C27H29NO7/c1-5-12-33-22-10-6-18(13-24(22)32-4)7-11-25(29)34-20-9-8-19-14-21(26(30)28-16-17(2)3)27(31)35-23(19)15-20/h6-11,13-15,17H,5,12,16H2,1-4H3,(H,28,30)/b11-7+