[4-[(4-methylphenyl)carbonyl-naphthalen-1-ylsulfonyl-amino]naphthalen-1-yl] 4-methylbenzoate

Systemtic Name: [4-[(4-methylphenyl)carbonyl-naphthalen-1-ylsulfonyl-amino]naphthalen-1-yl] 4-methylbenzoate Openeye Name: [4-[(4-methylbenzoyl)-(1-naphthylsulfonyl)amino]-1-naphthyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[[(4-methylphenyl)-oxomethyl]-(1-naphthalenylsulfonyl)amino]-1-naphthalenyl] ester IUPAC Name: [4-[(4-methylbenzoyl)-naphthalen-1-ylsulfonylamino]naphthalen-1-yl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[1-naphthylsulfonyl(p-toluoyl)amino]-1-naphthyl] ester Formula: C36H27NO5S MolecularWeight: 585.66828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)C)S(=O)(=O)C5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=CC=C(C3=CC=CC=C32)OC(=O)C4=CC=C(C=C4)C)S(=O)(=O)C5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C36H27NO5S/c1-24-14-18-27(19-15-24)35(38)37(43(40,41)34-13-7-9-26-8-3-4-10-29(26)34)32-22-23-33(31-12-6-5-11-30(31)32)42-36(39)28-20-16-25(2)17-21-28/h3-23H,1-2H3