carboxymethyl-(2-methyl-3-sulfanyl-propanoyl)-[(2-oxidanylidene-1,3-dihydroindol-3-yl)imino]azanium

Systemtic Name: carboxymethyl-(2-methyl-3-sulfanyl-propanoyl)-[(2-oxidanylidene-1,3-dihydroindol-3-yl)imino]azanium Openeye Name: carboxymethyl-(2-methyl-3-sulfanyl-propanoyl)-(2-oxoindolin-3-yl)imino-ammonium CAS Name: carboxymethyl-(3-mercapto-2-methyl-1-oxopropyl)-[(2-oxo-1,3-dihydroindol-3-yl)imino]ammonium IUPAC Name: carboxymethyl-(2-methyl-3-sulfanylpropanoyl)-[(2-oxo-1,3-dihydroindol-3-yl)imino]azanium Traditional Name: carboxymethyl-(2-ketoindolin-3-yl)imino-(3-mercapto-2-methyl-propanoyl)ammonium Formula: C14H16N3O4S+ MolecularWeight: 322.35954

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)[N+](=NC1C2=CC=CC=C2NC1=O)CC(=O)O

Isomeric SMILES

CC(CS)C(=O)[N+](=NC1C2=CC=CC=C2NC1=O)CC(=O)O

InChI

InChI=1S/C14H15N3O4S/c1-8(7-22)14(21)17(6-11(18)19)16-12-9-4-2-3-5-10(9)15-13(12)20/h2-5,8,12H,6-7H2,1H3,(H2-,15,18,19,20,22)/p+1