4-azanyl-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]butanamide

Systemtic Name: 4-azanyl-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]butanamide Openeye Name: 4-amino-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butanamide CAS Name: 4-amino-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butanamide IUPAC Name: 4-amino-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]butanamide Traditional Name: 4-amino-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]butyramide Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)CCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)CCCN

InChI

InChI=1S/C18H18N4O2/c19-10-4-9-16(23)20-13-6-3-5-12(11-13)17-14-7-1-2-8-15(14)18(24)22-21-17/h1-3,5-8,11H,4,9-10,19H2,(H,20,23)(H,22,24)