7-[[5-methylsulfonyl-2-[(E)-2-phenylethenyl]phenyl]amino]heptan-1-ol

Systemtic Name: 7-[[5-methylsulfonyl-2-[(E)-2-phenylethenyl]phenyl]amino]heptan-1-ol Openeye Name: 7-[5-methylsulfonyl-2-[(E)-styryl]anilino]heptan-1-ol CAS Name: 7-[5-methylsulfonyl-2-[(E)-2-phenylethenyl]anilino]-1-heptanol IUPAC Name: 7-[5-methylsulfonyl-2-[(E)-2-phenylethenyl]anilino]heptan-1-ol Traditional Name: 7-[5-mesyl-2-[(E)-styryl]anilino]heptan-1-ol Formula: C22H29NO3S MolecularWeight: 387.53556

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)C=CC2=CC=CC=C2)NCCCCCCCO

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)/C=C/C2=CC=CC=C2)NCCCCCCCO

InChI

InChI=1S/C22H29NO3S/c1-27(25,26)21-15-14-20(13-12-19-10-6-5-7-11-19)22(18-21)23-16-8-3-2-4-9-17-24/h5-7,10-15,18,23-24H,2-4,8-9,16-17H2,1H3/b13-12+