tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]phthalazin-1-yl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]phthalazin-1-yl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]phthalazin-1-yl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-[6-[5-[(cyclopropylamino)-oxomethyl]-2-methylphenyl]-1-phthalazinyl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[6-[5-(cyclopropylcarbamoyl)-2-methylphenyl]phthalazin-1-yl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-[6-[5-(cyclopropylcarbamoyl)-2-methyl-phenyl]phthalazin-1-yl]-3,6-dihydro-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C29H32N4O3 MolecularWeight: 484.58938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C5=CCN(CC5)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)C3=CC4=CN=NC(=C4C=C3)C5=CCN(CC5)C(=O)OC(C)(C)C

InChI

InChI=1S/C29H32N4O3/c1-18-5-6-21(27(34)31-23-8-9-23)16-25(18)20-7-10-24-22(15-20)17-30-32-26(24)19-11-13-33(14-12-19)28(35)36-29(2,3)4/h5-7,10-11,15-17,23H,8-9,12-14H2,1-4H3,(H,31,34)