5-nitro-N-[2-(4-propylphenoxy)ethyl]quinolin-8-amine

Systemtic Name: 5-nitro-N-[2-(4-propylphenoxy)ethyl]quinolin-8-amine Openeye Name: 5-nitro-N-[2-(4-propylphenoxy)ethyl]quinolin-8-amine CAS Name: 5-nitro-N-[2-(4-propylphenoxy)ethyl]-8-quinolinamine IUPAC Name: 5-nitro-N-[2-(4-propylphenoxy)ethyl]quinolin-8-amine Traditional Name: (5-nitro-8-quinolyl)-[2-(4-propylphenoxy)ethyl]amine Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCNC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCNC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C20H21N3O3/c1-2-4-15-6-8-16(9-7-15)26-14-13-21-18-10-11-19(23(24)25)17-5-3-12-22-20(17)18/h3,5-12,21H,2,4,13-14H2,1H3