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

Systemtic Name: [(2S)-2-methylbutyl] (E)-3-[4-[(4-decoxyphenyl)methylideneamino]phenyl]prop-2-enoate Openeye Name: [(2S)-2-methylbutyl] (E)-3-[4-[(4-decoxyphenyl)methyleneamino]phenyl]prop-2-enoate CAS Name: (E)-3-[4-[(4-decoxyphenyl)methylideneamino]phenyl]-2-propenoic acid [(2S)-2-methylbutyl] ester IUPAC Name: [(2S)-2-methylbutyl] (E)-3-[4-[(4-decoxyphenyl)methylideneamino]phenyl]prop-2-enoate Traditional Name: (E)-3-[4-[(4-decoxybenzylidene)amino]phenyl]acrylic acid [(2S)-2-methylbutyl] ester Formula: C31H43NO3 MolecularWeight: 477.67802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C=CC(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)/C=C/C(=O)OC[C@@H](C)CC

InChI

InChI=1S/C31H43NO3/c1-4-6-7-8-9-10-11-12-23-34-30-20-15-28(16-21-30)24-32-29-18-13-27(14-19-29)17-22-31(33)35-25-26(3)5-2/h13-22,24,26H,4-12,23,25H2,1-3H3/b22-17+,32-24?/t26-/m0/s1