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

Systemtic Name: 2-methylbutyl 4-[(4-octylphenyl)methylideneamino]benzoate Openeye Name: 2-methylbutyl 4-[(4-octylphenyl)methyleneamino]benzoate CAS Name: 4-[(4-octylphenyl)methylideneamino]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 4-[(4-octylphenyl)methylideneamino]benzoate Traditional Name: 4-[(4-octylbenzylidene)amino]benzoic acid 2-methylbutyl ester Formula: C27H37NO2 MolecularWeight: 407.58818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC(C)CC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)OCC(C)CC

InChI

InChI=1S/C27H37NO2/c1-4-6-7-8-9-10-11-23-12-14-24(15-13-23)20-28-26-18-16-25(17-19-26)27(29)30-21-22(3)5-2/h12-20,22H,4-11,21H2,1-3H3