8-[(3,5-ditert-butylphenyl)amino]naphthalene-1-sulfonate

Systemtic Name: 8-[(3,5-ditert-butylphenyl)amino]naphthalene-1-sulfonate Openeye Name: 8-(3,5-ditert-butylanilino)naphthalene-1-sulfonate CAS Name: 8-(3,5-ditert-butylanilino)-1-naphthalenesulfonate IUPAC Name: 8-(3,5-ditert-butylanilino)naphthalene-1-sulfonate Traditional Name: 8-(3,5-ditert-butylanilino)naphthalene-1-sulfonate Formula: C24H28NO3S- MolecularWeight: 410.54902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-])C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)NC2=CC=CC3=C2C(=CC=C3)S(=O)(=O)[O-])C(C)(C)C

InChI

InChI=1S/C24H29NO3S/c1-23(2,3)17-13-18(24(4,5)6)15-19(14-17)25-20-11-7-9-16-10-8-12-21(22(16)20)29(26,27)28/h7-15,25H,1-6H3,(H,26,27,28)/p-1