ethyl 3-(4-bromophenyl)carbonylpyrrolo[2,1-a]phthalazine-1-carboxylate

Systemtic Name: ethyl 3-(4-bromophenyl)carbonylpyrrolo[2,1-a]phthalazine-1-carboxylate Openeye Name: ethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]phthalazine-1-carboxylate CAS Name: 3-[(4-bromophenyl)-oxomethyl]-1-pyrrolo[2,1-a]phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-bromobenzoyl)pyrrolo[2,1-a]phthalazine-1-carboxylate Traditional Name: 3-(4-bromobenzoyl)pyrrolo[2,1-a]phthalazine-1-carboxylic acid ethyl ester Formula: C21H15BrN2O3 MolecularWeight: 423.2594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C3=CC=CC=C3C=NN2C(=C1)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)C1=C2C3=CC=CC=C3C=NN2C(=C1)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2O3/c1-2-27-21(26)17-11-18(20(25)13-7-9-15(22)10-8-13)24-19(17)16-6-4-3-5-14(16)12-23-24/h3-12H,2H2,1H3