N-[2-(4-methoxyphenyl)ethyl]-8-nitro-isoquinolin-5-amine

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-8-nitro-isoquinolin-5-amine Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-8-nitro-isoquinolin-5-amine CAS Name: N-[2-(4-methoxyphenyl)ethyl]-8-nitro-5-isoquinolinamine IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-8-nitroisoquinolin-5-amine Traditional Name: 2-(4-methoxyphenyl)ethyl-(8-nitro-5-isoquinolyl)amine Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-24-14-4-2-13(3-5-14)8-11-20-17-6-7-18(21(22)23)16-12-19-10-9-15(16)17/h2-7,9-10,12,20H,8,11H2,1H3