methyl 3-[5-indol-1-yl-6-(3-methoxy-3-oxidanylidene-propyl)-7,8-bis(oxidanylidene)naphthalen-2-yl]propanoate

Systemtic Name: methyl 3-[5-indol-1-yl-6-(3-methoxy-3-oxidanylidene-propyl)-7,8-bis(oxidanylidene)naphthalen-2-yl]propanoate Openeye Name: methyl 3-[5-indol-1-yl-6-(3-methoxy-3-oxo-propyl)-7,8-dioxo-2-naphthyl]propanoate CAS Name: 3-[5-(1-indolyl)-6-(3-methoxy-3-oxopropyl)-7,8-dioxo-2-naphthalenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[5-indol-1-yl-6-(3-methoxy-3-oxopropyl)-7,8-dioxonaphthalen-2-yl]propanoate Traditional Name: 3-[5-indol-1-yl-7,8-diketo-6-(3-keto-3-methoxy-propyl)-2-naphthyl]propionic acid methyl ester Formula: C26H23NO6 MolecularWeight: 445.46392

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC2=C(C=C1)C(=C(C(=O)C2=O)CCC(=O)OC)N3C=CC4=CC=CC=C43

Isomeric SMILES

COC(=O)CCC1=CC2=C(C=C1)C(=C(C(=O)C2=O)CCC(=O)OC)N3C=CC4=CC=CC=C43

InChI

InChI=1S/C26H23NO6/c1-32-22(28)11-8-16-7-9-18-20(15-16)26(31)25(30)19(10-12-23(29)33-2)24(18)27-14-13-17-5-3-4-6-21(17)27/h3-7,9,13-15H,8,10-12H2,1-2H3