[1-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperidin-4-yl]-piperidin-1-yl-methanone

Systemtic Name: [1-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylpiperidin-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]-4-piperidyl]-(1-piperidyl)methanone CAS Name: [1-[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]-oxomethyl]-4-piperidinyl]-(1-piperidinyl)methanone IUPAC Name: [1-[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]piperidin-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]-4-piperidyl]-piperidino-methanone Formula: C20H24N6O4 MolecularWeight: 412.44236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O4/c27-19(23-8-2-1-3-9-23)15-6-10-24(11-7-15)20(28)16-4-5-17(18(12-16)26(29)30)25-14-21-13-22-25/h4-5,12-15H,1-3,6-11H2