1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: 1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid 1-(4-oxo-1H-quinazolin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-1H-quinazolin-2-yl)ethyl 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid 1-(4-keto-1H-quinazolin-2-yl)ethyl ester Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC(C)C3=NC(=O)C4=CC=CC=C4N3)C

InChI

InChI=1S/C23H21N3O3/c1-14-8-9-15(2)26(14)18-12-10-17(11-13-18)23(28)29-16(3)21-24-20-7-5-4-6-19(20)22(27)25-21/h4-13,16H,1-3H3,(H,24,25,27)