6-nitro-N-[1-(phenylmethyl)piperidin-4-yl]-1,2-benzoxazole-3-carboxamide

Systemtic Name: 6-nitro-N-[1-(phenylmethyl)piperidin-4-yl]-1,2-benzoxazole-3-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-6-nitro-1,2-benzoxazole-3-carboxamide CAS Name: 6-nitro-N-[1-(phenylmethyl)-4-piperidinyl]-1,2-benzoxazole-3-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-6-nitro-1,2-benzoxazole-3-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-6-nitro-indoxazene-3-carboxamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=NOC3=C2C=CC(=C3)[N+](=O)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C20H20N4O4/c25-20(19-17-7-6-16(24(26)27)12-18(17)28-22-19)21-15-8-10-23(11-9-15)13-14-4-2-1-3-5-14/h1-7,12,15H,8-11,13H2,(H,21,25)