dimethyl 2-[[4-[4-(1-methylindol-3-yl)butoxy]phenyl]methyl]propanedioate

Systemtic Name: dimethyl 2-[[4-[4-(1-methylindol-3-yl)butoxy]phenyl]methyl]propanedioate Openeye Name: dimethyl 2-[[4-[4-(1-methylindol-3-yl)butoxy]phenyl]methyl]propanedioate CAS Name: 2-[[4-[4-(1-methyl-3-indolyl)butoxy]phenyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[4-[4-(1-methylindol-3-yl)butoxy]phenyl]methyl]propanedioate Traditional Name: 2-[4-[4-(1-methylindol-3-yl)butoxy]benzyl]malonic acid dimethyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CCCCOC3=CC=C(C=C3)CC(C(=O)OC)C(=O)OC

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CCCCOC3=CC=C(C=C3)CC(C(=O)OC)C(=O)OC

InChI

InChI=1S/C25H29NO5/c1-26-17-19(21-9-4-5-10-23(21)26)8-6-7-15-31-20-13-11-18(12-14-20)16-22(24(27)29-2)25(28)30-3/h4-5,9-14,17,22H,6-8,15-16H2,1-3H3