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

Systemtic Name: [2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate Openeye Name: [3-(allylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hexoxy-3-methoxyphenyl)-2-propenoic acid [2-oxo-3-[oxo-(prop-2-enylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(prop-2-enylcarbamoyl)chromen-7-yl] (E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)acrylic acid [3-(allylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C29H31NO7 MolecularWeight: 505.55894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C)OC

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C)OC

InChI

InChI=1S/C29H31NO7/c1-4-6-7-8-16-35-24-13-9-20(17-26(24)34-3)10-14-27(31)36-22-12-11-21-18-23(28(32)30-15-5-2)29(33)37-25(21)19-22/h5,9-14,17-19H,2,4,6-8,15-16H2,1,3H3,(H,30,32)/b14-10+