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

Systemtic Name: methyl 6,6-bis(3,7-dimethyl-2-oxidanylidene-1,3-benzoxazol-5-yl)hex-5-enoate Openeye Name: methyl 6,6-bis(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)hex-5-enoate CAS Name: 6,6-bis(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)-5-hexenoic acid methyl ester IUPAC Name: methyl 6,6-bis(3,7-dimethyl-2-oxo-1,3-benzoxazol-5-yl)hex-5-enoate Traditional Name: 6,6-bis(2-keto-3,7-dimethyl-1,3-benzoxazol-5-yl)hex-5-enoic acid methyl ester Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=CCCCC(=O)OC)C3=CC(=C4C(=C3)N(C(=O)O4)C)C)N(C(=O)O2)C

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=CCCCC(=O)OC)C3=CC(=C4C(=C3)N(C(=O)O4)C)C)N(C(=O)O2)C

InChI

InChI=1S/C25H26N2O6/c1-14-10-16(12-19-22(14)32-24(29)26(19)3)18(8-6-7-9-21(28)31-5)17-11-15(2)23-20(13-17)27(4)25(30)33-23/h8,10-13H,6-7,9H2,1-5H3