[(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-3,4-dihydro-2H-naphthalen-1-yl]methyl 4-methylbenzenesulfonate

Systemtic Name: [(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-3,4-dihydro-2H-naphthalen-1-yl]methyl 4-methylbenzenesulfonate Openeye Name: [(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-tetralin-1-yl]methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-3,4-dihydro-2H-naphthalen-1-yl]methyl ester IUPAC Name: [(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-3,4-dihydro-2H-naphthalen-1-yl]methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(1S,4R)-1-(ethylcarbamoyl)-4-phenyl-tetralin-1-yl]methyl ester Formula: C27H29NO4S MolecularWeight: 463.58846

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1(CCC(C2=CC=CC=C21)C3=CC=CC=C3)COS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCNC(=O)[C@]1(CC[C@@H](C2=CC=CC=C21)C3=CC=CC=C3)COS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H29NO4S/c1-3-28-26(29)27(19-32-33(30,31)22-15-13-20(2)14-16-22)18-17-23(21-9-5-4-6-10-21)24-11-7-8-12-25(24)27/h4-16,23H,3,17-19H2,1-2H3,(H,28,29)/t23-,27-/m1/s1