4-[(4-methoxyphenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-[(4-methoxyphenyl)carbonylamino]-5-oxidanyl-naphthalene-2,7-disulfonic acid Openeye Name: 4-hydroxy-5-[(4-methoxybenzoyl)amino]naphthalene-2,7-disulfonic acid CAS Name: 4-hydroxy-5-[[(4-methoxyphenyl)-oxomethyl]amino]naphthalene-2,7-disulfonic acid IUPAC Name: 4-hydroxy-5-[(4-methoxybenzoyl)amino]naphthalene-2,7-disulfonic acid Traditional Name: 4-hydroxy-5-(p-anisoylamino)naphthalene-2,7-disulfonic acid Formula: C18H15NO9S2 MolecularWeight: 453.443

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O

InChI

InChI=1S/C18H15NO9S2/c1-28-12-4-2-10(3-5-12)18(21)19-15-8-13(29(22,23)24)6-11-7-14(30(25,26)27)9-16(20)17(11)15/h2-9,20H,1H3,(H,19,21)(H,22,23,24)(H,25,26,27)