2-[(3-methoxyphenyl)carbonylamino]-3-thiomorpholin-4-yl-propanoic acid

Systemtic Name: 2-[(3-methoxyphenyl)carbonylamino]-3-thiomorpholin-4-yl-propanoic acid Openeye Name: 2-[(3-methoxybenzoyl)amino]-3-thiomorpholino-propanoic acid CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]-3-thiomorpholin-4-ylpropanoic acid IUPAC Name: 2-[(3-methoxybenzoyl)amino]-3-thiomorpholin-4-ylpropanoic acid Traditional Name: 2-(m-anisoylamino)-3-thiomorpholino-propionic acid Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CN2CCSCC2)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(CN2CCSCC2)C(=O)O

InChI

InChI=1S/C15H20N2O4S/c1-21-12-4-2-3-11(9-12)14(18)16-13(15(19)20)10-17-5-7-22-8-6-17/h2-4,9,13H,5-8,10H2,1H3,(H,16,18)(H,19,20)