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

Systemtic Name: [3-(butylcarbamoyl)-2-oxidanylidene-chromen-7-yl] (E)-3-(4-hexoxy-3-methoxy-phenyl)prop-2-enoate Openeye Name: [3-(butylcarbamoyl)-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 [3-[butylamino(oxo)methyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(butylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(4-hexoxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hexoxy-3-methoxy-phenyl)acrylic acid [3-(butylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C30H35NO7 MolecularWeight: 521.6014

Click to see the large picture

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)NCCCC)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)NCCCC)OC

InChI

InChI=1S/C30H35NO7/c1-4-6-8-9-17-36-25-14-10-21(18-27(25)35-3)11-15-28(32)37-23-13-12-22-19-24(29(33)31-16-7-5-2)30(34)38-26(22)20-23/h10-15,18-20H,4-9,16-17H2,1-3H3,(H,31,33)/b15-11+