4-azanyl-5-oxidanyl-naphthalene-2,7-disulfonic acid; 5-azanyl-2-phenylazanyl-benzenesulfonic acid; benzene-1,3-diol; 4-nitroaniline

Systemtic Name: 4-azanyl-5-oxidanyl-naphthalene-2,7-disulfonic acid; 5-azanyl-2-phenylazanyl-benzenesulfonic acid; benzene-1,3-diol; 4-nitroaniline Openeye Name: 5-amino-2-anilino-benzenesulfonic acid; 4-amino-5-hydroxy-naphthalene-2,7-disulfonic acid; benzene-1,3-diol; 4-nitroaniline CAS Name: 5-amino-2-anilinobenzenesulfonic acid; 4-amino-5-hydroxynaphthalene-2,7-disulfonic acid; benzene-1,3-diol; 4-nitroaniline IUPAC Name: 5-amino-2-anilinobenzenesulfonic acid; 4-amino-5-hydroxynaphthalene-2,7-disulfonic acid; benzene-1,3-diol; 4-nitroaniline Traditional Name: 5-amino-2-anilino-besylic acid; 4-amino-5-hydroxy-naphthalene-2,7-disulfonic acid; (4-nitrophenyl)amine; resorcinol Formula: C34H33N5O14S3 MolecularWeight: 831.84592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)S(=O)(=O)O.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1N)[N+](=O)[O-].C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C=C(C=C2)N)S(=O)(=O)O.C1=CC(=CC(=C1)O)O.C1=CC(=CC=C1N)[N+](=O)[O-].C1=C2C=C(C=C(C2=C(C=C1S(=O)(=O)O)N)O)S(=O)(=O)O

InChI

InChI=1S/C12H12N2O3S.C10H9NO7S2.C6H6N2O2.C6H6O2/c13-9-6-7-11(12(8-9)18(15,16)17)14-10-4-2-1-3-5-10;11-8-3-6(19(13,14)15)1-5-2-7(20(16,17)18)4-9(12)10(5)8;7-5-1-3-6(4-2-5)8(9)10;7-5-2-1-3-6(8)4-5/h1-8,14H,13H2,(H,15,16,17);1-4,12H,11H2,(H,13,14,15)(H,16,17,18);1-4H,7H2;1-4,7-8H