3-nitro-4-(piperidin-1-ylmethyl)aniline

Systemtic Name: 3-nitro-4-(piperidin-1-ylmethyl)aniline Openeye Name: 3-nitro-4-(1-piperidylmethyl)aniline CAS Name: 3-nitro-4-(1-piperidinylmethyl)aniline IUPAC Name: 3-nitro-4-(piperidin-1-ylmethyl)aniline Traditional Name: [3-nitro-4-(piperidinomethyl)phenyl]amine Formula: C12H17N3O2 MolecularWeight: 235.28228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=C(C=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)CC2=C(C=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O2/c13-11-5-4-10(12(8-11)15(16)17)9-14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,9,13H2