2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitro-phenol

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitro-phenol Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitro-phenol CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitrophenol IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitrophenol Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-6-methoxy-4-nitro-phenol Formula: C17H18N2O4 MolecularWeight: 314.33582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)[N+](=O)[O-])CN2CCC3=CC=CC=C3C2)O

Isomeric SMILES

COC1=C(C(=CC(=C1)[N+](=O)[O-])CN2CCC3=CC=CC=C3C2)O

InChI

InChI=1S/C17H18N2O4/c1-23-16-9-15(19(21)22)8-14(17(16)20)11-18-7-6-12-4-2-3-5-13(12)10-18/h2-5,8-9,20H,6-7,10-11H2,1H3