[2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-(4-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-(4-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(4-methylpiperidino)sulfonylbenzoic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C(C=C(C=C3)C)N4N=C5C=CC=CC5=N4

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=C(C=C(C=C3)C)N4N=C5C=CC=CC5=N4

InChI

InChI=1S/C26H26N4O4S/c1-18-12-14-29(15-13-18)35(32,33)21-7-5-6-20(17-21)26(31)34-25-11-10-19(2)16-24(25)30-27-22-8-3-4-9-23(22)28-30/h3-11,16-18H,12-15H2,1-2H3