2-[but-3-enoxycarbonyl(2-sulfanylethyl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[but-3-enoxycarbonyl(2-sulfanylethyl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[but-3-enoxycarbonyl(2-sulfanylethyl)amino]-4-methyl-pentanoic acid CAS Name: 2-[[but-3-enoxy(oxo)methyl]-(2-mercaptoethyl)amino]-4-methylpentanoic acid IUPAC Name: 2-[but-3-enoxycarbonyl(2-sulfanylethyl)amino]-4-methylpentanoic acid Traditional Name: 2-[but-3-enoxycarbonyl(2-mercaptoethyl)amino]-4-methyl-valeric acid Formula: C13H23NO4S MolecularWeight: 289.39102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)N(CCS)C(=O)OCCC=C

Isomeric SMILES

CC(C)CC(C(=O)O)N(CCS)C(=O)OCCC=C

InChI

InChI=1S/C13H23NO4S/c1-4-5-7-18-13(17)14(6-8-19)11(12(15)16)9-10(2)3/h4,10-11,19H,1,5-9H2,2-3H3,(H,15,16)