2-[(E)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoxy]ethyl (E)-3-azanylbut-2-enoate

Systemtic Name: 2-[(E)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoxy]ethyl (E)-3-azanylbut-2-enoate Openeye Name: 2-[(E)-2-methyl-3-[4-(3-pyridylmethyl)phenyl]allyloxy]ethyl (E)-3-aminobut-2-enoate CAS Name: (E)-3-amino-2-butenoic acid 2-[(E)-2-methyl-3-[4-(3-pyridinylmethyl)phenyl]prop-2-enoxy]ethyl ester IUPAC Name: 2-[(E)-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]prop-2-enoxy]ethyl (E)-3-aminobut-2-enoate Traditional Name: (E)-3-aminobut-2-enoic acid 2-[(E)-2-methyl-3-[4-(3-pyridylmethyl)phenyl]allyloxy]ethyl ester Formula: C22H26N2O3 MolecularWeight: 366.45344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=C(C=C1)CC2=CN=CC=C2)COCCOC(=O)C=C(C)N

Isomeric SMILES

C/C(=C\C1=CC=C(C=C1)CC2=CN=CC=C2)/COCCOC(=O)/C=C(\C)/N

InChI

InChI=1S/C22H26N2O3/c1-17(16-26-10-11-27-22(25)13-18(2)23)12-19-5-7-20(8-6-19)14-21-4-3-9-24-15-21/h3-9,12-13,15H,10-11,14,16,23H2,1-2H3/b17-12+,18-13+