[(E)-7-phenyl-7-pyridin-3-yl-hept-6-enyl] N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: [(E)-7-phenyl-7-pyridin-3-yl-hept-6-enyl] N-(4-methylphenyl)sulfonylcarbamate Openeye Name: [(E)-7-phenyl-7-(3-pyridyl)hept-6-enyl] N-(p-tolylsulfonyl)carbamate CAS Name: N-(4-methylphenyl)sulfonylcarbamic acid [(E)-7-phenyl-7-(3-pyridinyl)hept-6-enyl] ester IUPAC Name: [(E)-7-phenyl-7-pyridin-3-ylhept-6-enyl] N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamic acid [(E)-7-phenyl-7-(3-pyridyl)hept-6-enyl] ester Formula: C26H28N2O4S MolecularWeight: 464.57652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OCCCCCC=C(C2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)OCCCCC/C=C(\C2=CC=CC=C2)/C3=CN=CC=C3

InChI

InChI=1S/C26H28N2O4S/c1-21-14-16-24(17-15-21)33(30,31)28-26(29)32-19-8-3-2-7-13-25(22-10-5-4-6-11-22)23-12-9-18-27-20-23/h4-6,9-18,20H,2-3,7-8,19H2,1H3,(H,28,29)/b25-13+