3-[4-[(E)-2-[4-(icosan-3-ylamino)phenyl]ethenyl]phenyl]sulfonylpropan-1-ol

Systemtic Name: 3-[4-[(E)-2-[4-(icosan-3-ylamino)phenyl]ethenyl]phenyl]sulfonylpropan-1-ol Openeye Name: 3-[4-[(E)-2-[4-(1-ethyloctadecylamino)phenyl]vinyl]phenyl]sulfonylpropan-1-ol CAS Name: 3-[4-[(E)-2-[4-(eicosan-3-ylamino)phenyl]ethenyl]phenyl]sulfonyl-1-propanol IUPAC Name: 3-[4-[(E)-2-[4-(icosan-3-ylamino)phenyl]ethenyl]phenyl]sulfonylpropan-1-ol Traditional Name: 3-[4-[(E)-2-[4-(1-ethyloctadecylamino)phenyl]vinyl]phenyl]sulfonylpropan-1-ol Formula: C37H59NO3S MolecularWeight: 597.93426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CC)NC1=CC=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)CCCO

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CC)NC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)CCCO

InChI

InChI=1S/C37H59NO3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-35(4-2)38-36-27-23-33(24-28-36)21-22-34-25-29-37(30-26-34)42(40,41)32-19-31-39/h21-30,35,38-39H,3-20,31-32H2,1-2H3/b22-21+