ethyl (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxidanylidene-octanoate

Systemtic Name: ethyl (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxidanylidene-octanoate Openeye Name: ethyl (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxo-octanoate CAS Name: (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxooctanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-oxooctanoate Traditional Name: (2E)-2-(4,4-diphenyl-1,3-dihydroquinazolin-2-ylidene)-3-keto-caprylic acid ethyl ester Formula: C30H32N2O3 MolecularWeight: 468.58668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(=C1NC2=CC=CC=C2C(N1)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCCCCC(=O)/C(=C\1/NC2=CC=CC=C2C(N1)(C3=CC=CC=C3)C4=CC=CC=C4)/C(=O)OCC

InChI

InChI=1S/C30H32N2O3/c1-3-5-8-21-26(33)27(29(34)35-4-2)28-31-25-20-14-13-19-24(25)30(32-28,22-15-9-6-10-16-22)23-17-11-7-12-18-23/h6-7,9-20,31-32H,3-5,8,21H2,1-2H3/b28-27+