2-[1-(2-azanylpropanoyl)piperidin-4-yl]-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one

Systemtic Name: 2-[1-(2-azanylpropanoyl)piperidin-4-yl]-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 2-[1-(2-aminopropanoyl)-4-piperidyl]-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 2-[1-(2-amino-1-oxopropyl)-4-piperidinyl]-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 2-[1-(2-aminopropanoyl)piperidin-4-yl]-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 2-(1-alanyl-4-piperidyl)-4-(3,4-dimethoxyphenyl)-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C24H32N4O4 MolecularWeight: 440.53528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)N2C(=O)C3CC=CCC3C(=N2)C4=CC(=C(C=C4)OC)OC)N

Isomeric SMILES

CC(C(=O)N1CCC(CC1)N2C(=O)C3CC=CCC3C(=N2)C4=CC(=C(C=C4)OC)OC)N

InChI

InChI=1S/C24H32N4O4/c1-15(25)23(29)27-12-10-17(11-13-27)28-24(30)19-7-5-4-6-18(19)22(26-28)16-8-9-20(31-2)21(14-16)32-3/h4-5,8-9,14-15,17-19H,6-7,10-13,25H2,1-3H3