ethyl 6-methyl-3-(4-nitrophenyl)carbonyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylate

Systemtic Name: ethyl 6-methyl-3-(4-nitrophenyl)carbonyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylate Openeye Name: ethyl 6-methyl-3-(4-nitrobenzoyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylate CAS Name: 6-methyl-3-[(4-nitrophenyl)-oxomethyl]-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-3-(4-nitrobenzoyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylate Traditional Name: 6-methyl-3-(4-nitrobenzoyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]phthalazine-1-carboxylic acid ethyl ester Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(N2C1C3=CC=CC=C3C(=N2)C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CC(N2C1C3=CC=CC=C3C(=N2)C)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O5/c1-3-30-22(27)18-12-19(21(26)14-8-10-15(11-9-14)25(28)29)24-20(18)17-7-5-4-6-16(17)13(2)23-24/h4-11,18-20H,3,12H2,1-2H3