[2,4,6-tri(propan-2-yl)phenyl] 2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethanesulfonate

Systemtic Name: [2,4,6-tri(propan-2-yl)phenyl] 2-[bis(phenylmethyl)amino]-2-oxidanylidene-ethanesulfonate Openeye Name: (2,4,6-triisopropylphenyl) 2-(dibenzylamino)-2-oxo-ethanesulfonate CAS Name: 2-[bis(phenylmethyl)amino]-2-oxoethanesulfonic acid [2,4,6-tri(propan-2-yl)phenyl] ester IUPAC Name: [2,4,6-tri(propan-2-yl)phenyl] 2-(dibenzylamino)-2-oxoethanesulfonate Traditional Name: 2-(dibenzylamino)-2-keto-ethanesulfonic acid (2,4,6-triisopropylphenyl) ester Formula: C31H39NO4S MolecularWeight: 521.71066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)OS(=O)(=O)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)OS(=O)(=O)CC(=O)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C31H39NO4S/c1-22(2)27-17-28(23(3)4)31(29(18-27)24(5)6)36-37(34,35)21-30(33)32(19-25-13-9-7-10-14-25)20-26-15-11-8-12-16-26/h7-18,22-24H,19-21H2,1-6H3