4-[(E)-5-[(4-butoxyphenyl)-(3-morpholin-4-ylpropyl)amino]-1-oxidanyl-pent-3-enyl]phenol

Systemtic Name: 4-[(E)-5-[(4-butoxyphenyl)-(3-morpholin-4-ylpropyl)amino]-1-oxidanyl-pent-3-enyl]phenol Openeye Name: 4-[(E)-5-[4-butoxy-N-(3-morpholinopropyl)anilino]-1-hydroxy-pent-3-enyl]phenol CAS Name: 4-[(E)-5-[4-butoxy-N-[3-(4-morpholinyl)propyl]anilino]-1-hydroxypent-3-enyl]phenol IUPAC Name: 4-[(E)-5-[4-butoxy-N-(3-morpholin-4-ylpropyl)anilino]-1-hydroxypent-3-enyl]phenol Traditional Name: 4-[(E)-5-[4-butoxy-N-(3-morpholinopropyl)anilino]-1-hydroxy-pent-3-enyl]phenol Formula: C28H40N2O4 MolecularWeight: 468.6282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(CCCN2CCOCC2)CC=CCC(C3=CC=C(C=C3)O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(CCCN2CCOCC2)C/C=C/CC(C3=CC=C(C=C3)O)O

InChI

InChI=1S/C28H40N2O4/c1-2-3-21-34-27-14-10-25(11-15-27)30(18-6-16-29-19-22-33-23-20-29)17-5-4-7-28(32)24-8-12-26(31)13-9-24/h4-5,8-15,28,31-32H,2-3,6-7,16-23H2,1H3/b5-4+