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

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-chlorophenyl)prop-2-enoate Openeye Name: [3-(butylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(4-chlorophenyl)prop-2-enoate CAS Name: (E)-3-(4-chlorophenyl)-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-chlorophenyl)prop-2-enoate Traditional Name: (E)-3-(4-chlorophenyl)acrylic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C23H20ClNO5 MolecularWeight: 425.8616

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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)Cl)OC1=O

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClNO5/c1-2-3-12-25-22(27)19-13-16-7-10-18(14-20(16)30-23(19)28)29-21(26)11-6-15-4-8-17(24)9-5-15/h4-11,13-14H,2-3,12H2,1H3,(H,25,27)/b11-6+