N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]phthalazine-1-carboxamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3OC)N4CCCC4

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3OC)N4CCCC4

InChI

InChI=1S/C25H30N4O3/c1-17(2)29-25(31)19-11-5-4-10-18(19)23(27-29)24(30)26-16-21(28-14-8-9-15-28)20-12-6-7-13-22(20)32-3/h4-7,10-13,17,21H,8-9,14-16H2,1-3H3,(H,26,30)