methyl 5-[[4-(1H-indol-3-yl)butanoyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[4-(1H-indol-3-yl)butanoyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[4-(1H-indol-3-yl)butanoyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[4-(1H-indol-3-yl)-1-oxobutyl]-methylamino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(1H-indol-3-yl)butanoyl-methylamino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[4-(1H-indol-3-yl)butanoyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)CCCC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)CCCC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C21H24N2O4/c1-14-18(21(25)26-3)11-16(27-14)13-23(2)20(24)10-6-7-15-12-22-19-9-5-4-8-17(15)19/h4-5,8-9,11-12,22H,6-7,10,13H2,1-3H3