N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(2-diethylaminoethyl)-4-keto-3-(4-methoxyphenyl)phthalazine-1-carboxamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26N4O3/c1-4-25(5-2)15-14-23-21(27)20-18-8-6-7-9-19(18)22(28)26(24-20)16-10-12-17(29-3)13-11-16/h6-13H,4-5,14-15H2,1-3H3,(H,23,27)