[3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]sulfanyl 5-chloranylindole-1-carboxylate

Systemtic Name: [3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propyl]sulfanyl 5-chloranylindole-1-carboxylate Openeye Name: (3-tert-butoxy-3-oxo-propyl)sulfanyl 5-chloroindole-1-carboxylate CAS Name: 5-chloro-1-indolecarboxylic acid [[3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]thio] ester IUPAC Name: [3-[(2-methylpropan-2-yl)oxy]-3-oxopropyl]sulfanyl 5-chloroindole-1-carboxylate Traditional Name: 5-chloroindole-1-carboxylic acid [(3-tert-butoxy-3-keto-propyl)thio] ester Formula: C16H18ClNO4S MolecularWeight: 355.83642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCSOC(=O)N1C=CC2=C1C=CC(=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)CCSOC(=O)N1C=CC2=C1C=CC(=C2)Cl

InChI

InChI=1S/C16H18ClNO4S/c1-16(2,3)21-14(19)7-9-23-22-15(20)18-8-6-11-10-12(17)4-5-13(11)18/h4-6,8,10H,7,9H2,1-3H3