4-oxidanyl-7-[(5-oxidanylnaphthalen-2-yl)carbamoylamino]naphthalene-2-sulfonic acid

Systemtic Name: 4-oxidanyl-7-[(5-oxidanylnaphthalen-2-yl)carbamoylamino]naphthalene-2-sulfonic acid Openeye Name: 4-hydroxy-7-[(5-hydroxy-2-naphthyl)carbamoylamino]naphthalene-2-sulfonic acid CAS Name: 4-hydroxy-7-[[[(5-hydroxy-2-naphthalenyl)amino]-oxomethyl]amino]-2-naphthalenesulfonic acid IUPAC Name: 4-hydroxy-7-[(5-hydroxynaphthalen-2-yl)carbamoylamino]naphthalene-2-sulfonic acid Traditional Name: 4-hydroxy-7-[(5-hydroxy-2-naphthyl)carbamoylamino]naphthalene-2-sulfonic acid Formula: C21H16N2O6S MolecularWeight: 424.42654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)C(=C1)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)NC(=O)NC3=CC4=CC(=CC(=C4C=C3)O)S(=O)(=O)O)C(=C1)O

InChI

InChI=1S/C21H16N2O6S/c24-19-3-1-2-12-8-14(4-6-17(12)19)22-21(26)23-15-5-7-18-13(9-15)10-16(11-20(18)25)30(27,28)29/h1-11,24-25H,(H2,22,23,26)(H,27,28,29)