(2S)-3-methyl-2-[(phenylmethyl)-[2-(phenylsulfonyl)prop-2-enyl]amino]butan-1-ol

Systemtic Name: (2S)-3-methyl-2-[(phenylmethyl)-[2-(phenylsulfonyl)prop-2-enyl]amino]butan-1-ol Openeye Name: (2S)-2-[2-(benzenesulfonyl)allyl-benzyl-amino]-3-methyl-butan-1-ol CAS Name: (2S)-2-[2-(benzenesulfonyl)prop-2-enyl-(phenylmethyl)amino]-3-methyl-1-butanol IUPAC Name: (2S)-2-[2-(benzenesulfonyl)prop-2-enyl-benzylamino]-3-methylbutan-1-ol Traditional Name: (2S)-2-[benzyl(2-besylallyl)amino]-3-methyl-butan-1-ol Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO3S/c1-17(2)21(16-23)22(15-19-10-6-4-7-11-19)14-18(3)26(24,25)20-12-8-5-9-13-20/h4-13,17,21,23H,3,14-16H2,1-2H3/t21-/m1/s1