[4-[4-nitro-3-(4-propylpiperidin-1-yl)phenoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[4-nitro-3-(4-propylpiperidin-1-yl)phenoxy]phenyl]-phenyl-methanone Openeye Name: [4-[4-nitro-3-(4-propyl-1-piperidyl)phenoxy]phenyl]-phenyl-methanone CAS Name: [4-[4-nitro-3-(4-propyl-1-piperidinyl)phenoxy]phenyl]-phenylmethanone IUPAC Name: [4-[4-nitro-3-(4-propylpiperidin-1-yl)phenoxy]phenyl]-phenylmethanone Traditional Name: [4-[4-nitro-3-(4-propylpiperidino)phenoxy]phenyl]-phenyl-methanone Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCN(CC1)C2=C(C=CC(=C2)OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCC1CCN(CC1)C2=C(C=CC(=C2)OC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H28N2O4/c1-2-6-20-15-17-28(18-16-20)26-19-24(13-14-25(26)29(31)32)33-23-11-9-22(10-12-23)27(30)21-7-4-3-5-8-21/h3-5,7-14,19-20H,2,6,15-18H2,1H3