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

Systemtic Name: methyl (E)-3-[4-[2-[(2-oxidanyl-2-phenyl-ethyl)amino]propyl]phenyl]but-2-enoate Openeye Name: methyl (E)-3-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]phenyl]but-2-enoate CAS Name: (E)-3-[4-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]phenyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]phenyl]but-2-enoate Traditional Name: (E)-3-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]phenyl]but-2-enoic acid methyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=CC(=O)OC)C)NCC(C2=CC=CC=C2)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)/C(=C/C(=O)OC)/C)NCC(C2=CC=CC=C2)O

InChI

InChI=1S/C22H27NO3/c1-16(13-22(25)26-3)19-11-9-18(10-12-19)14-17(2)23-15-21(24)20-7-5-4-6-8-20/h4-13,17,21,23-24H,14-15H2,1-3H3/b16-13+