ethyl 1-(3-methylbutyl)-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate

Systemtic Name: ethyl 1-(3-methylbutyl)-5-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Openeye Name: ethyl 1-isopentyl-5-(3-methyl-4-oxo-phthalazine-1-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate CAS Name: 1-(3-methylbutyl)-5-[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-methylbutyl)-5-(3-methyl-4-oxophthalazine-1-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylate Traditional Name: 1-isoamyl-5-(4-keto-3-methyl-phthalazine-1-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxylic acid ethyl ester Formula: C24H29N5O4 MolecularWeight: 451.51816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C)CCC(C)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1CN(CC2)C(=O)C3=NN(C(=O)C4=CC=CC=C43)C)CCC(C)C

InChI

InChI=1S/C24H29N5O4/c1-5-33-24(32)21-18-14-28(12-11-19(18)29(26-21)13-10-15(2)3)23(31)20-16-8-6-7-9-17(16)22(30)27(4)25-20/h6-9,15H,5,10-14H2,1-4H3