2-(hydroxymethyl)-5-[2-(4-nitrophenyl)ethyl]-3,4-dipentoxy-benzamide

Systemtic Name: 2-(hydroxymethyl)-5-[2-(4-nitrophenyl)ethyl]-3,4-dipentoxy-benzamide Openeye Name: 2-(hydroxymethyl)-5-[2-(4-nitrophenyl)ethyl]-3,4-dipentoxy-benzamide CAS Name: 2-(hydroxymethyl)-5-[2-(4-nitrophenyl)ethyl]-3,4-dipentoxybenzamide IUPAC Name: 2-(hydroxymethyl)-5-[2-(4-nitrophenyl)ethyl]-3,4-dipentoxybenzamide Traditional Name: 3,4-diamoxy-2-methylol-5-[2-(4-nitrophenyl)ethyl]benzamide Formula: C26H36N2O6 MolecularWeight: 472.57384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C(=C1OCCCCC)CO)C(=O)N)CCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCOC1=C(C=C(C(=C1OCCCCC)CO)C(=O)N)CCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C26H36N2O6/c1-3-5-7-15-33-24-20(12-9-19-10-13-21(14-11-19)28(31)32)17-22(26(27)30)23(18-29)25(24)34-16-8-6-4-2/h10-11,13-14,17,29H,3-9,12,15-16,18H2,1-2H3,(H2,27,30)