2-methylbutyl (E)-3-[4-[(4-hexoxyphenyl)methylideneamino]phenyl]prop-2-enoate

Systemtic Name: 2-methylbutyl (E)-3-[4-[(4-hexoxyphenyl)methylideneamino]phenyl]prop-2-enoate Openeye Name: 2-methylbutyl (E)-3-[4-[(4-hexoxyphenyl)methyleneamino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(4-hexoxyphenyl)methylideneamino]phenyl]-2-propenoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl (E)-3-[4-[(4-hexoxyphenyl)methylideneamino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(4-hexoxybenzylidene)amino]phenyl]acrylic acid 2-methylbutyl ester Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C=CC(=O)OCC(C)CC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)/C=C/C(=O)OCC(C)CC

InChI

InChI=1S/C27H35NO3/c1-4-6-7-8-19-30-26-16-11-24(12-17-26)20-28-25-14-9-23(10-15-25)13-18-27(29)31-21-22(3)5-2/h9-18,20,22H,4-8,19,21H2,1-3H3/b18-13+,28-20?