7-[2-azanyl-6-methylsulfonyl-3-[(E)-2-phenylethenyl]phenyl]heptan-1-ol

Systemtic Name: 7-[2-azanyl-6-methylsulfonyl-3-[(E)-2-phenylethenyl]phenyl]heptan-1-ol Openeye Name: 7-[2-amino-6-methylsulfonyl-3-[(E)-styryl]phenyl]heptan-1-ol CAS Name: 7-[2-amino-6-methylsulfonyl-3-[(E)-2-phenylethenyl]phenyl]-1-heptanol IUPAC Name: 7-[2-amino-6-methylsulfonyl-3-[(E)-2-phenylethenyl]phenyl]heptan-1-ol Traditional Name: 7-[2-amino-6-mesyl-3-[(E)-styryl]phenyl]heptan-1-ol Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C(=C(C=C1)C=CC2=CC=CC=C2)N)CCCCCCCO

Isomeric SMILES

CS(=O)(=O)C1=C(C(=C(C=C1)/C=C/C2=CC=CC=C2)N)CCCCCCCO

InChI

InChI=1S/C22H29NO3S/c1-27(25,26)21-16-15-19(14-13-18-10-6-5-7-11-18)22(23)20(21)12-8-3-2-4-9-17-24/h5-7,10-11,13-16,24H,2-4,8-9,12,17,23H2,1H3/b14-13+