(Z)-2-methylidene-3-[(2-methyl-1-sulfo-propyl)carbamoyl]hex-3-enoic acid

Systemtic Name: (Z)-2-methylidene-3-[(2-methyl-1-sulfo-propyl)carbamoyl]hex-3-enoic acid Openeye Name: (Z)-2-methylene-3-[(2-methyl-1-sulfo-propyl)carbamoyl]hex-3-enoic acid CAS Name: (Z)-2-methylene-3-[[(2-methyl-1-sulfopropyl)amino]-oxomethyl]-3-hexenoic acid IUPAC Name: (Z)-2-methylidene-3-[(2-methyl-1-sulfopropyl)carbamoyl]hex-3-enoic acid Traditional Name: (Z)-2-methylene-3-[(2-methyl-1-sulfo-propyl)carbamoyl]hex-3-enoic acid Formula: C12H19NO6S MolecularWeight: 305.34736

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C(=C)C(=O)O)C(=O)NC(C(C)C)S(=O)(=O)O

Isomeric SMILES

CC/C=C(/C(=C)C(=O)O)\C(=O)NC(C(C)C)S(=O)(=O)O

InChI

InChI=1S/C12H19NO6S/c1-5-6-9(8(4)12(15)16)10(14)13-11(7(2)3)20(17,18)19/h6-7,11H,4-5H2,1-3H3,(H,13,14)(H,15,16)(H,17,18,19)/b9-6-