4-(aminomethyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride

Systemtic Name: 4-(aminomethyl)-N-[3-(4-oxidanylidene-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride Openeye Name: 4-(aminomethyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride CAS Name: 4-(aminomethyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride IUPAC Name: 4-(aminomethyl)-N-[3-(4-oxo-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride Traditional Name: 4-(aminomethyl)-N-[3-(4-keto-3H-phthalazin-1-yl)phenyl]benzamide hydrochloride Formula: C22H19ClN4O2 MolecularWeight: 406.86486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)CN.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)CN.Cl

InChI

InChI=1S/C22H18N4O2.ClH/c23-13-14-8-10-15(11-9-14)21(27)24-17-5-3-4-16(12-17)20-18-6-1-2-7-19(18)22(28)26-25-20;/h1-12H,13,23H2,(H,24,27)(H,26,28);1H