dimethyl-[(1S)-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC(C3=CC=CC=C3)[NH+](C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC[C@H](C3=CC=CC=C3)[NH+](C)C

InChI

InChI=1S/C22H26N4O2/c1-4-14-26-22(28)18-13-9-8-12-17(18)20(24-26)21(27)23-15-19(25(2)3)16-10-6-5-7-11-16/h5-13,19H,4,14-15H2,1-3H3,(H,23,27)/p+1/t19-/m1/s1