4-[(4-nitrophenyl)carbonylamino]naphthalene-1,5-disulfonic acid

Systemtic Name: 4-[(4-nitrophenyl)carbonylamino]naphthalene-1,5-disulfonic acid Openeye Name: 4-[(4-nitrobenzoyl)amino]naphthalene-1,5-disulfonic acid CAS Name: 4-[[(4-nitrophenyl)-oxomethyl]amino]naphthalene-1,5-disulfonic acid IUPAC Name: 4-[(4-nitrobenzoyl)amino]naphthalene-1,5-disulfonic acid Traditional Name: 4-[(4-nitrobenzoyl)amino]naphthalene-1,5-disulfonic acid Formula: C17H12N2O9S2 MolecularWeight: 452.41518

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])S(=O)(=O)O

InChI

InChI=1S/C17H12N2O9S2/c20-17(10-4-6-11(7-5-10)19(21)22)18-13-8-9-14(29(23,24)25)12-2-1-3-15(16(12)13)30(26,27)28/h1-9H,(H,18,20)(H,23,24,25)(H,26,27,28)