2-(ethoxycarbothioylamino)-3-phenyl-propanoic acid

Systemtic Name: 2-(ethoxycarbothioylamino)-3-phenyl-propanoic acid Openeye Name: 2-(ethoxycarbothioylamino)-3-phenyl-propanoic acid CAS Name: 2-[[ethoxy(sulfanylidene)methyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-(ethoxycarbothioylamino)-3-phenylpropanoic acid Traditional Name: 2-(ethoxycarbothioylamino)-3-phenyl-propionic acid Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)NC(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCOC(=S)NC(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C12H15NO3S/c1-2-16-12(17)13-10(11(14)15)8-9-6-4-3-5-7-9/h3-7,10H,2,8H2,1H3,(H,13,17)(H,14,15)