2-nitro-4-[2-[2-(phenylmethyl)piperidin-1-yl]ethoxy]aniline

Systemtic Name: 2-nitro-4-[2-[2-(phenylmethyl)piperidin-1-yl]ethoxy]aniline Openeye Name: 4-[2-(2-benzyl-1-piperidyl)ethoxy]-2-nitro-aniline CAS Name: 2-nitro-4-[2-[2-(phenylmethyl)-1-piperidinyl]ethoxy]aniline IUPAC Name: 4-[2-(2-benzylpiperidin-1-yl)ethoxy]-2-nitroaniline Traditional Name: [4-[2-(2-benzylpiperidino)ethoxy]-2-nitro-phenyl]amine Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CC2=CC=CC=C2)CCOC3=CC(=C(C=C3)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CC2=CC=CC=C2)CCOC3=CC(=C(C=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O3/c21-19-10-9-18(15-20(19)23(24)25)26-13-12-22-11-5-4-8-17(22)14-16-6-2-1-3-7-16/h1-3,6-7,9-10,15,17H,4-5,8,11-14,21H2