1-[4-(1,2-dithiolan-3-yl)butylcarbamoyl]-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[4-(1,2-dithiolan-3-yl)butylcarbamoyl]-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[4-(dithiolan-3-yl)butylcarbamoyl]indoline-2-carboxylic acid CAS Name: 1-[[4-(3-dithiolanyl)butylamino]-oxomethyl]-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[4-(dithiolan-3-yl)butylcarbamoyl]-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[4-(dithiolan-3-yl)butylcarbamoyl]indoline-2-carboxylic acid Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

C1CSSC1CCCCNC(=O)N2C(CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CSSC1CCCCNC(=O)N2C(CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H22N2O3S2/c20-16(21)15-11-12-5-1-2-7-14(12)19(15)17(22)18-9-4-3-6-13-8-10-23-24-13/h1-2,5,7,13,15H,3-4,6,8-11H2,(H,18,22)(H,20,21)