1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-[(4-nitrophenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-(4-nitrobenzyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4/c19-15-8-11-5-6-17-14(13(11)9-16(15)20)7-10-1-3-12(4-2-10)18(21)22/h1-4,8-9,14,17,19-20H,5-7H2