4-[2-(2-azanylhexylamino)-3-[[(E)-5-methyl-1-phenyl-hex-1-en-3-yl]amino]propyl]phenol

Systemtic Name: 4-[2-(2-azanylhexylamino)-3-[[(E)-5-methyl-1-phenyl-hex-1-en-3-yl]amino]propyl]phenol Openeye Name: 4-[2-(2-aminohexylamino)-3-[[3-methyl-1-[(E)-styryl]butyl]amino]propyl]phenol CAS Name: 4-[2-(2-aminohexylamino)-3-[[(E)-5-methyl-1-phenylhex-1-en-3-yl]amino]propyl]phenol IUPAC Name: 4-[2-(2-aminohexylamino)-3-[[(E)-5-methyl-1-phenylhex-1-en-3-yl]amino]propyl]phenol Traditional Name: 4-[2-(2-aminohexylamino)-3-[[(E)-1-isobutyl-3-phenyl-allyl]amino]propyl]phenol Formula: C28H43N3O MolecularWeight: 437.66052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC(CC1=CC=C(C=C1)O)CNC(CC(C)C)C=CC2=CC=CC=C2)N

Isomeric SMILES

CCCCC(CNC(CC1=CC=C(C=C1)O)CNC(CC(C)C)/C=C/C2=CC=CC=C2)N

InChI

InChI=1S/C28H43N3O/c1-4-5-11-25(29)20-30-27(19-24-13-16-28(32)17-14-24)21-31-26(18-22(2)3)15-12-23-9-7-6-8-10-23/h6-10,12-17,22,25-27,30-32H,4-5,11,18-21,29H2,1-3H3/b15-12+