1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride

Systemtic Name: 1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Openeye Name: 1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride CAS Name: 1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride IUPAC Name: 1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Traditional Name: 1-(3-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Formula: C15H15ClN2O4 MolecularWeight: 322.7436

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O4.ClH/c18-13-7-9-4-5-16-15(12(9)8-14(13)19)10-2-1-3-11(6-10)17(20)21;/h1-3,6-8,15-16,18-19H,4-5H2;1H