2-azanyl-5-[4-(decoxycarbonylamino)-3-methyl-phenyl]-4-methyl-benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[4-(decoxycarbonylamino)-3-methyl-phenyl]-4-methyl-benzenesulfonic acid Openeye Name: 2-amino-5-[4-(decoxycarbonylamino)-3-methyl-phenyl]-4-methyl-benzenesulfonic acid CAS Name: 2-amino-5-[4-[[decoxy(oxo)methyl]amino]-3-methylphenyl]-4-methylbenzenesulfonic acid IUPAC Name: 2-amino-5-[4-(decoxycarbonylamino)-3-methylphenyl]-4-methylbenzenesulfonic acid Traditional Name: 2-amino-5-[4-(decoxycarbonylamino)-3-methyl-phenyl]-4-methyl-besylic acid Formula: C25H36N2O5S MolecularWeight: 476.62874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2C)N)S(=O)(=O)O)C

Isomeric SMILES

CCCCCCCCCCOC(=O)NC1=C(C=C(C=C1)C2=CC(=C(C=C2C)N)S(=O)(=O)O)C

InChI

InChI=1S/C25H36N2O5S/c1-4-5-6-7-8-9-10-11-14-32-25(28)27-23-13-12-20(15-19(23)3)21-17-24(33(29,30)31)22(26)16-18(21)2/h12-13,15-17H,4-11,14,26H2,1-3H3,(H,27,28)(H,29,30,31)