1-(2-azanyl-3-nitro-phenoxy)-3-[phenyl(piperidin-4-yl)amino]propan-1-ol; N-butylmethanamide

Systemtic Name: 1-(2-azanyl-3-nitro-phenoxy)-3-[phenyl(piperidin-4-yl)amino]propan-1-ol; N-butylmethanamide Openeye Name: 1-(2-amino-3-nitro-phenoxy)-3-[N-(4-piperidyl)anilino]propan-1-ol; N-butylformamide CAS Name: 1-(2-amino-3-nitrophenoxy)-3-[N-(4-piperidinyl)anilino]-1-propanol; N-butylformamide IUPAC Name: 1-(2-amino-3-nitrophenoxy)-3-(N-piperidin-4-ylanilino)propan-1-ol; N-butylformamide Traditional Name: 1-(2-amino-3-nitro-phenoxy)-3-[N-(4-piperidyl)anilino]propan-1-ol; N-butylformamide Formula: C25H37N5O5 MolecularWeight: 487.59178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC=O.C1CNCCC1N(CCC(O)OC2=CC=CC(=C2N)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCCCNC=O.C1CNCCC1N(CCC(O)OC2=CC=CC(=C2N)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H26N4O4.C5H11NO/c21-20-17(24(26)27)7-4-8-18(20)28-19(25)11-14-23(15-5-2-1-3-6-15)16-9-12-22-13-10-16;1-2-3-4-6-5-7/h1-8,16,19,22,25H,9-14,21H2;5H,2-4H2,1H3,(H,6,7)