3-(4-methoxyphenyl)-4-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)phthalazine-1-carboxamide

Systemtic Name: 3-(4-methoxyphenyl)-4-oxidanylidene-N-(3-pyrrolidin-1-ylpropyl)phthalazine-1-carboxamide Openeye Name: 3-(4-methoxyphenyl)-4-oxo-N-(3-pyrrolidin-1-ylpropyl)phthalazine-1-carboxamide CAS Name: 3-(4-methoxyphenyl)-4-oxo-N-[3-(1-pyrrolidinyl)propyl]-1-phthalazinecarboxamide IUPAC Name: 3-(4-methoxyphenyl)-4-oxo-N-(3-pyrrolidin-1-ylpropyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-(4-methoxyphenyl)-N-(3-pyrrolidinopropyl)phthalazine-1-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCN4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCN4CCCC4

InChI

InChI=1S/C23H26N4O3/c1-30-18-11-9-17(10-12-18)27-23(29)20-8-3-2-7-19(20)21(25-27)22(28)24-13-6-16-26-14-4-5-15-26/h2-3,7-12H,4-6,13-16H2,1H3,(H,24,28)