4-acetamido-5-nitro-2-oxidanyl-N-[1-(phenylmethyl)piperidin-4-yl]benzamide

Systemtic Name: 4-acetamido-5-nitro-2-oxidanyl-N-[1-(phenylmethyl)piperidin-4-yl]benzamide Openeye Name: 4-acetamido-N-(1-benzyl-4-piperidyl)-2-hydroxy-5-nitro-benzamide CAS Name: 4-acetamido-2-hydroxy-5-nitro-N-[1-(phenylmethyl)-4-piperidinyl]benzamide IUPAC Name: 4-acetamido-N-(1-benzylpiperidin-4-yl)-2-hydroxy-5-nitrobenzamide Traditional Name: 4-acetamido-N-(1-benzyl-4-piperidyl)-2-hydroxy-5-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C(=C1)O)C(=O)NC2CCN(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=C(C=C(C(=C1)O)C(=O)NC2CCN(CC2)CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-14(26)22-18-12-20(27)17(11-19(18)25(29)30)21(28)23-16-7-9-24(10-8-16)13-15-5-3-2-4-6-15/h2-6,11-12,16,27H,7-10,13H2,1H3,(H,22,26)(H,23,28)