methyl (E)-2-acetamido-3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]prop-2-enoate

Systemtic Name: methyl (E)-2-acetamido-3-[4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]prop-2-enoate Openeye Name: methyl (E)-2-acetamido-3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]prop-2-enoate CAS Name: (E)-2-acetamido-3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-2-acetamido-3-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]prop-2-enoate Traditional Name: (E)-2-acetamido-3-[4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]acrylic acid methyl ester Formula: C18H26N2O5 MolecularWeight: 350.40944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=C(C=C1)C=C(C(=O)OC)NC(=O)C)O

Isomeric SMILES

CC(C)NCC(COC1=CC=C(C=C1)/C=C(\C(=O)OC)/NC(=O)C)O

InChI

InChI=1S/C18H26N2O5/c1-12(2)19-10-15(22)11-25-16-7-5-14(6-8-16)9-17(18(23)24-4)20-13(3)21/h5-9,12,15,19,22H,10-11H2,1-4H3,(H,20,21)/b17-9+