3-methyl-N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-ylidene]amino]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[(Z)-[(1S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-ylidene]amino]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[(Z)-[(1S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-ylidene]amino]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[(Z)-[(2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethylidene]amino]phthalazine-1-carboxamide Formula: C23H26N5O3+ MolecularWeight: 420.48424

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)C(C3=CC=CC=C3)[NH+]4CCOCC4

Isomeric SMILES

C/C(=N/NC(=O)C1=NN(C(=O)C2=CC=CC=C21)C)/[C@H](C3=CC=CC=C3)[NH+]4CCOCC4

InChI

InChI=1S/C23H25N5O3/c1-16(21(17-8-4-3-5-9-17)28-12-14-31-15-13-28)24-25-22(29)20-18-10-6-7-11-19(18)23(30)27(2)26-20/h3-11,21H,12-15H2,1-2H3,(H,25,29)/p+1/b24-16-/t21-/m1/s1