4-oxidanylidene-3-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)-4-piperidin-1-yl-butanal

Systemtic Name: 4-oxidanylidene-3-(3-oxidanylidene-5-phenyl-1H-1,2,4-triazol-2-yl)-4-piperidin-1-yl-butanal Openeye Name: 4-oxo-3-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-4-(1-piperidyl)butanal CAS Name: 4-oxo-3-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-4-(1-piperidinyl)butanal IUPAC Name: 4-oxo-3-(3-oxo-5-phenyl-1H-1,2,4-triazol-2-yl)-4-piperidin-1-ylbutanal Traditional Name: 4-keto-3-(3-keto-5-phenyl-1H-1,2,4-triazol-2-yl)-4-piperidino-butyraldehyde Formula: C17H20N4O3 MolecularWeight: 328.3657

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CC=O)N2C(=O)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)C(CC=O)N2C(=O)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O3/c22-12-9-14(16(23)20-10-5-2-6-11-20)21-17(24)18-15(19-21)13-7-3-1-4-8-13/h1,3-4,7-8,12,14H,2,5-6,9-11H2,(H,18,19,24)