ethyl 3-methyl-4-[4-[3-[(1-oxidanylpyridin-2-ylidene)amino]propoxy]phenyl]-3-pyridin-3-yl-butanoate

Systemtic Name: ethyl 3-methyl-4-[4-[3-[(1-oxidanylpyridin-2-ylidene)amino]propoxy]phenyl]-3-pyridin-3-yl-butanoate Openeye Name: ethyl 4-[4-[3-[(1-hydroxy-2-pyridylidene)amino]propoxy]phenyl]-3-methyl-3-(3-pyridyl)butanoate CAS Name: 4-[4-[3-[(1-hydroxy-2-pyridinylidene)amino]propoxy]phenyl]-3-methyl-3-(3-pyridinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[3-[(1-hydroxypyridin-2-ylidene)amino]propoxy]phenyl]-3-methyl-3-pyridin-3-ylbutanoate Traditional Name: 4-[4-[3-[(1-hydroxy-2-pyridylidene)amino]propoxy]phenyl]-3-methyl-3-(3-pyridyl)butyric acid ethyl ester Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(CC1=CC=C(C=C1)OCCCN=C2C=CC=CN2O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CC(C)(CC1=CC=C(C=C1)OCCCN=C2C=CC=CN2O)C3=CN=CC=C3

InChI

InChI=1S/C26H31N3O4/c1-3-32-25(30)19-26(2,22-8-6-14-27-20-22)18-21-10-12-23(13-11-21)33-17-7-15-28-24-9-4-5-16-29(24)31/h4-6,8-14,16,20,31H,3,7,15,17-19H2,1-2H3