2-(8-tert-butyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoic acid

Systemtic Name: 2-(8-tert-butyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoic acid Openeye Name: 2-(8-tert-butyl-2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid CAS Name: 2-(8-tert-butyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid IUPAC Name: 2-(8-tert-butyl-2-propan-2-yl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid Traditional Name: 2-(8-tert-butyl-2-isopropyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid Formula: C17H23NO3S MolecularWeight: 321.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=S)N(C2=CC=CC(=C2O1)C(C)(C)C)CC(=O)O

Isomeric SMILES

CC(C)C1C(=S)N(C2=CC=CC(=C2O1)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C17H23NO3S/c1-10(2)14-16(22)18(9-13(19)20)12-8-6-7-11(15(12)21-14)17(3,4)5/h6-8,10,14H,9H2,1-5H3,(H,19,20)