N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-pyrrolidin-1-yl-aniline

Systemtic Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-pyrrolidin-1-yl-aniline Openeye Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-pyrrolidin-1-yl-aniline CAS Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-(1-pyrrolidinyl)aniline IUPAC Name: N-[2-(3,4-dimethylphenoxy)ethyl]-2-nitro-5-pyrrolidin-1-ylaniline Traditional Name: 2-(3,4-dimethylphenoxy)ethyl-(2-nitro-5-pyrrolidino-phenyl)amine Formula: C20H25N3O3 MolecularWeight: 355.4308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCNC2=C(C=CC(=C2)N3CCCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCNC2=C(C=CC(=C2)N3CCCC3)[N+](=O)[O-])C

InChI

InChI=1S/C20H25N3O3/c1-15-5-7-18(13-16(15)2)26-12-9-21-19-14-17(22-10-3-4-11-22)6-8-20(19)23(24)25/h5-8,13-14,21H,3-4,9-12H2,1-2H3