[4-[pyridin-4-ylcarbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate

Systemtic Name: [4-[pyridin-4-ylcarbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]naphthalen-1-yl] pyridine-4-carboxylate Openeye Name: [4-[pyridine-4-carbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-1-naphthyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [4-[[oxo(pyridin-4-yl)methyl]-(2,4,6-trimethylphenyl)sulfonylamino]-1-naphthalenyl] ester IUPAC Name: [4-[pyridine-4-carbonyl-(2,4,6-trimethylphenyl)sulfonylamino]naphthalen-1-yl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [4-[isonicotinoyl(mesitylsulfonyl)amino]-1-naphthyl] ester Formula: C31H25N3O5S MolecularWeight: 551.6123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=NC=C4)C(=O)C5=CC=NC=C5)C

InChI

InChI=1S/C31H25N3O5S/c1-20-18-21(2)29(22(3)19-20)40(37,38)34(30(35)23-10-14-32-15-11-23)27-8-9-28(26-7-5-4-6-25(26)27)39-31(36)24-12-16-33-17-13-24/h4-19H,1-3H3