methyl 2-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate

Systemtic Name: methyl 2-(4-oxidanylidene-3-propan-2-yl-phthalazin-1-yl)carbonyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Openeye Name: methyl 2-(3-isopropyl-4-oxo-phthalazine-1-carbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate CAS Name: 2-[oxo-(4-oxo-3-propan-2-yl-1-phthalazinyl)methyl]-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-oxo-3-propan-2-ylphthalazine-1-carbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylate Traditional Name: 2-(3-isopropyl-4-keto-phthalazine-1-carbonyl)-1,3,4,5-tetrahydropyrid[4,3-b]indole-8-carboxylic acid methyl ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)C(=O)OC

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N3CCC4=C(C3)C5=C(N4)C=CC(=C5)C(=O)OC

InChI

InChI=1S/C25H24N4O4/c1-14(2)29-23(30)17-7-5-4-6-16(17)22(27-29)24(31)28-11-10-21-19(13-28)18-12-15(25(32)33-3)8-9-20(18)26-21/h4-9,12,14,26H,10-11,13H2,1-3H3