(4-oxidanylidene-4-thiophen-2-yl-butyl) 1-methylindole-3-carboxylate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 1-methylindole-3-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 1-methylindole-3-carboxylate CAS Name: 1-methyl-3-indolecarboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 1-methylindole-3-carboxylate Traditional Name: 1-methylindole-3-carboxylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)OCCCC(=O)C3=CC=CS3

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)OCCCC(=O)C3=CC=CS3

InChI

InChI=1S/C18H17NO3S/c1-19-12-14(13-6-2-3-7-15(13)19)18(21)22-10-4-8-16(20)17-9-5-11-23-17/h2-3,5-7,9,11-12H,4,8,10H2,1H3