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

Systemtic Name: 3-azanyl-N-[[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]propanamide CAS Name: 3-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]propanamide IUPAC Name: 3-amino-N-[[3-(4-oxo-3H-phthalazin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-amino-N-[3-(4-keto-3H-phthalazin-1-yl)benzyl]propionamide 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)CNC(=O)CCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)CNC(=O)CCN

InChI

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