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2-methanethioyl-2-(naphthalen-1-ylmethyl)-4,5-bis(oxidanyl)pentanoic acid

2-methanethioyl-2-(naphthalen-1-ylmethyl)-4,5-bis(oxidanyl)pentanoic acid

Systemtic Name:2-methanethioyl-2-(naphthalen-1-ylmethyl)-4,5-bis(oxidanyl)pentanoic acid
Openeye Name:4,5-dihydroxy-2-methanethioyl-2-(1-naphthylmethyl)pentanoic acid
CAS Name:4,5-dihydroxy-2-methanethioyl-2-(1-naphthalenylmethyl)pentanoic acid
IUPAC Name:4,5-dihydroxy-2-methanethioyl-2-(naphthalen-1-ylmethyl)pentanoic acid
Traditional Name:4,5-dihydroxy-2-(1-naphthylmethyl)-2-thioformyl-valeric acid
Formula: C17H18O4S
MolecularWeight: 318.38742
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(CC(CO)O)(C=S)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(CC(CO)O)(C=S)C(=O)O


InChI

InChI=1S/C17H18O4S/c18-10-14(19)9-17(11-22,16(20)21)8-13-6-3-5-12-4-1-2-7-15(12)13/h1-7,11,14,18-19H,8-10H2,(H,20,21)


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