diethyl 2-[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-methyl-indol-3-yl]-2-oxidanyl-propanedioate

Systemtic Name: diethyl 2-[2-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-methyl-indol-3-yl]-2-oxidanyl-propanedioate Openeye Name: diethyl 2-hydroxy-2-[2-[(E)-3-methoxy-3-oxo-prop-1-enyl]-1-methyl-indol-3-yl]propanedioate CAS Name: 2-hydroxy-2-[2-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-methyl-3-indolyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-hydroxy-2-[2-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-methylindol-3-yl]propanedioate Traditional Name: 2-hydroxy-2-[2-[(E)-3-keto-3-methoxy-prop-1-enyl]-1-methyl-indol-3-yl]malonic acid diethyl ester Formula: C20H23NO7 MolecularWeight: 389.39912

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N(C2=CC=CC=C21)C)C=CC(=O)OC)(C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C(C1=C(N(C2=CC=CC=C21)C)/C=C/C(=O)OC)(C(=O)OCC)O

InChI

InChI=1S/C20H23NO7/c1-5-27-18(23)20(25,19(24)28-6-2)17-13-9-7-8-10-14(13)21(3)15(17)11-12-16(22)26-4/h7-12,25H,5-6H2,1-4H3/b12-11+