4-ethyl-N-[1-(1-methylpiperidin-4-yl)ethyl]-3-nitro-aniline

Systemtic Name: 4-ethyl-N-[1-(1-methylpiperidin-4-yl)ethyl]-3-nitro-aniline Openeye Name: 4-ethyl-N-[1-(1-methyl-4-piperidyl)ethyl]-3-nitro-aniline CAS Name: 4-ethyl-N-[1-(1-methyl-4-piperidinyl)ethyl]-3-nitroaniline IUPAC Name: 4-ethyl-N-[1-(1-methylpiperidin-4-yl)ethyl]-3-nitroaniline Traditional Name: (4-ethyl-3-nitro-phenyl)-[1-(1-methyl-4-piperidyl)ethyl]amine Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NC(C)C2CCN(CC2)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NC(C)C2CCN(CC2)C)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O2/c1-4-13-5-6-15(11-16(13)19(20)21)17-12(2)14-7-9-18(3)10-8-14/h5-6,11-12,14,17H,4,7-10H2,1-3H3