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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

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