2-methylbutyl 4-[(4-octoxyphenyl)methylideneamino]benzoate

Systemtic Name: 2-methylbutyl 4-[(4-octoxyphenyl)methylideneamino]benzoate Openeye Name: 2-methylbutyl 4-[(4-octoxyphenyl)methyleneamino]benzoate CAS Name: 4-[(4-octoxyphenyl)methylideneamino]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[(4-octoxyphenyl)methylideneamino]benzoate Traditional Name: 4-[(4-octoxybenzylidene)amino]benzoic acid 2-methylbutyl ester Formula: C27H37NO3 MolecularWeight: 423.58758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC(C)CC

InChI

InChI=1S/C27H37NO3/c1-4-6-7-8-9-10-19-30-26-17-11-23(12-18-26)20-28-25-15-13-24(14-16-25)27(29)31-21-22(3)5-2/h11-18,20,22H,4-10,19,21H2,1-3H3