N-[1-(1-ethylpiperidin-3-yl)ethyl]-2-methyl-3-nitro-aniline

Systemtic Name: N-[1-(1-ethylpiperidin-3-yl)ethyl]-2-methyl-3-nitro-aniline Openeye Name: N-[1-(1-ethyl-3-piperidyl)ethyl]-2-methyl-3-nitro-aniline CAS Name: N-[1-(1-ethyl-3-piperidinyl)ethyl]-2-methyl-3-nitroaniline IUPAC Name: N-[1-(1-ethylpiperidin-3-yl)ethyl]-2-methyl-3-nitroaniline Traditional Name: 1-(1-ethyl-3-piperidyl)ethyl-(2-methyl-3-nitro-phenyl)amine Formula: C16H25N3O2 MolecularWeight: 291.3886

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(C1)C(C)NC2=C(C(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCN1CCCC(C1)C(C)NC2=C(C(=CC=C2)[N+](=O)[O-])C

InChI

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