2-[2-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]ethanoylamino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[2-[(4-methyl-2-oxidanylidene-chromen-7-yl)amino]ethanoylamino]-3-sulfanyl-propanoic acid Openeye Name: 2-[[2-[(4-methyl-2-oxo-chromen-7-yl)amino]acetyl]amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)amino]-1-oxoethyl]amino]propanoic acid IUPAC Name: 2-[[2-[(4-methyl-2-oxochromen-7-yl)amino]acetyl]amino]-3-sulfanylpropanoic acid Traditional Name: 2-[[2-[(2-keto-4-methyl-chromen-7-yl)amino]acetyl]amino]-3-mercapto-propionic acid Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NCC(=O)NC(CS)C(=O)O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NCC(=O)NC(CS)C(=O)O

InChI

InChI=1S/C15H16N2O5S/c1-8-4-14(19)22-12-5-9(2-3-10(8)12)16-6-13(18)17-11(7-23)15(20)21/h2-5,11,16,23H,6-7H2,1H3,(H,17,18)(H,20,21)