methyl (E)-3-[4-[2-[[3-(2-chloranylphenoxy)-2-oxidanyl-propyl]amino]propyl]phenyl]but-2-enoate

Systemtic Name: methyl (E)-3-[4-[2-[[3-(2-chloranylphenoxy)-2-oxidanyl-propyl]amino]propyl]phenyl]but-2-enoate Openeye Name: methyl (E)-3-[4-[2-[[3-(2-chlorophenoxy)-2-hydroxy-propyl]amino]propyl]phenyl]but-2-enoate CAS Name: (E)-3-[4-[2-[[3-(2-chlorophenoxy)-2-hydroxypropyl]amino]propyl]phenyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[2-[[3-(2-chlorophenoxy)-2-hydroxypropyl]amino]propyl]phenyl]but-2-enoate Traditional Name: (E)-3-[4-[2-[[3-(2-chlorophenoxy)-2-hydroxy-propyl]amino]propyl]phenyl]but-2-enoic acid methyl ester Formula: C23H28ClNO4 MolecularWeight: 417.92572

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=CC(=O)OC)C)NCC(COC2=CC=CC=C2Cl)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)/C(=C/C(=O)OC)/C)NCC(COC2=CC=CC=C2Cl)O

InChI

InChI=1S/C23H28ClNO4/c1-16(12-23(27)28-3)19-10-8-18(9-11-19)13-17(2)25-14-20(26)15-29-22-7-5-4-6-21(22)24/h4-12,17,20,25-26H,13-15H2,1-3H3/b16-12+