N-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethoxy)phenyl]-3-butyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[4-(2-amino-2-oxo-ethoxy)phenyl]-3-butyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[4-(2-amino-2-oxoethoxy)phenyl]-3-butyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[4-(2-amino-2-oxoethoxy)phenyl]-3-butyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[4-(2-amino-2-keto-ethoxy)phenyl]-3-butyl-4-keto-phthalazine-1-carboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OCC(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=C(C=C3)OCC(=O)N

InChI

InChI=1S/C21H22N4O4/c1-2-3-12-25-21(28)17-7-5-4-6-16(17)19(24-25)20(27)23-14-8-10-15(11-9-14)29-13-18(22)26/h4-11H,2-3,12-13H2,1H3,(H2,22,26)(H,23,27)