4-dodecylbenzenesulfonic acid; 4-phenyldiazenylbenzene-1,3-diamine

Systemtic Name: 4-dodecylbenzenesulfonic acid; 4-phenyldiazenylbenzene-1,3-diamine Openeye Name: 4-dodecylbenzenesulfonic acid; 4-phenylazobenzene-1,3-diamine CAS Name: 4-dodecylbenzenesulfonic acid; 4-phenyldiazenylbenzene-1,3-diamine IUPAC Name: 4-dodecylbenzenesulfonic acid; 4-phenyldiazenylbenzene-1,3-diamine Traditional Name: (3-amino-4-phenylazo-phenyl)amine; 4-laurylbesylic acid Formula: C30H42N4O3S MolecularWeight: 538.74448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)N=NC2=C(C=C(C=C2)N)N

InChI

InChI=1S/C18H30O3S.C12H12N4/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;13-9-6-7-12(11(14)8-9)16-15-10-4-2-1-3-5-10/h13-16H,2-12H2,1H3,(H,19,20,21);1-8H,13-14H2