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

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

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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)NC(C)CC)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)NC(C)CC)OC

InChI

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