7-azanyl-8-oxidanylidene-3-[(4-oxidanylnaphthalen-2-yl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-8-oxidanylidene-3-[(4-oxidanylnaphthalen-2-yl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-[(4-hydroxy-2-naphthyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(4-hydroxy-2-naphthalenyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-[(4-hydroxynaphthalen-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-3-[(4-hydroxy-2-naphthyl)methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CC3=CC4=CC=CC=C4C(=C3)O

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)N)C(=O)O)CC3=CC4=CC=CC=C4C(=C3)O

InChI

InChI=1S/C18H16N2O4S/c19-14-16(22)20-15(18(23)24)11(8-25-17(14)20)6-9-5-10-3-1-2-4-12(10)13(21)7-9/h1-5,7,14,17,21H,6,8,19H2,(H,23,24)