tert-butyl 2-[(S)-(4-methylphenyl)-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]methyl]prop-2-enoate

Systemtic Name: tert-butyl 2-[(S)-(4-methylphenyl)-[(4-methylphenyl)sulfonyl-prop-2-enyl-amino]methyl]prop-2-enoate Openeye Name: tert-butyl 2-[(S)-[allyl(p-tolylsulfonyl)amino]-(p-tolyl)methyl]prop-2-enoate CAS Name: 2-[(S)-(4-methylphenyl)-[(4-methylphenyl)sulfonyl-prop-2-enylamino]methyl]-2-propenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(S)-(4-methylphenyl)-[(4-methylphenyl)sulfonyl-prop-2-enylamino]methyl]prop-2-enoate Traditional Name: 2-[(S)-[allyl(tosyl)amino]-(p-tolyl)methyl]acrylic acid tert-butyl ester Formula: C25H31NO4S MolecularWeight: 441.58294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C(=C)C(=O)OC(C)(C)C)N(CC=C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C(=C)C(=O)OC(C)(C)C)N(CC=C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C25H31NO4S/c1-8-17-26(31(28,29)22-15-11-19(3)12-16-22)23(21-13-9-18(2)10-14-21)20(4)24(27)30-25(5,6)7/h8-16,23H,1,4,17H2,2-3,5-7H3/t23-/m1/s1