2-[1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindol-4-yl]ethanoic acid

Systemtic Name: 2-[1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindol-4-yl]ethanoic acid Openeye Name: 2-[1-(p-tolylsulfonyl)-4,5,6,7-tetrahydroindol-4-yl]acetic acid CAS Name: 2-[1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindol-4-yl]acetic acid IUPAC Name: 2-[1-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydroindol-4-yl]acetic acid Traditional Name: 2-(1-tosyl-4,5,6,7-tetrahydroindol-4-yl)acetic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2CCCC3CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC3=C2CCCC3CC(=O)O

InChI

InChI=1S/C17H19NO4S/c1-12-5-7-14(8-6-12)23(21,22)18-10-9-15-13(11-17(19)20)3-2-4-16(15)18/h5-10,13H,2-4,11H2,1H3,(H,19,20)