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

Systemtic Name: methyl (Z)-3-[4-[2-[(2-oxidanyl-2-phenyl-ethyl)amino]ethyl]phenyl]but-2-enoate Openeye Name: methyl (Z)-3-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]ethyl]phenyl]but-2-enoate CAS Name: (Z)-3-[4-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]phenyl]-2-butenoic acid methyl ester IUPAC Name: methyl (Z)-3-[4-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]phenyl]but-2-enoate Traditional Name: (Z)-3-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]ethyl]phenyl]but-2-enoic acid methyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OC)C1=CC=C(C=C1)CCNCC(C2=CC=CC=C2)O

Isomeric SMILES

C/C(=C/C(=O)OC)/C1=CC=C(C=C1)CCNCC(C2=CC=CC=C2)O

InChI

InChI=1S/C21H25NO3/c1-16(14-21(24)25-2)18-10-8-17(9-11-18)12-13-22-15-20(23)19-6-4-3-5-7-19/h3-11,14,20,22-23H,12-13,15H2,1-2H3/b16-14-