methyl (Z)-6-(4-cyanophenyl)-6-(3,7-dimethyl-2-oxidanylidene-1,3-benzoxazol-5-yl)hex-5-enoate

Systemtic Name: methyl (Z)-6-(4-cyanophenyl)-6-(3,7-dimethyl-2-oxidanylidene-1,3-benzoxazol-5-yl)hex-5-enoate Openeye Name: methyl (Z)-6-(4-cyanophenyl)-6-(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)hex-5-enoate CAS Name: (Z)-6-(4-cyanophenyl)-6-(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)-5-hexenoic acid methyl ester IUPAC Name: methyl (Z)-6-(4-cyanophenyl)-6-(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)hex-5-enoate Traditional Name: (Z)-6-(4-cyanophenyl)-6-(2-keto-3,7-dimethyl-1,3-benzoxazol-5-yl)hex-5-enoic acid methyl ester Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=CCCCC(=O)OC)C3=CC=C(C=C3)C#N)N(C(=O)O2)C

Isomeric SMILES

CC1=C2C(=CC(=C1)/C(=C\CCCC(=O)OC)/C3=CC=C(C=C3)C#N)N(C(=O)O2)C

InChI

InChI=1S/C23H22N2O4/c1-15-12-18(13-20-22(15)29-23(27)25(20)2)19(6-4-5-7-21(26)28-3)17-10-8-16(14-24)9-11-17/h6,8-13H,4-5,7H2,1-3H3/b19-6-