5-(4-nitrophenyl)sulfanyl-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 5-(4-nitrophenyl)sulfanyl-1,2,3,4-tetrahydroisoquinoline Openeye Name: 5-(4-nitrophenyl)sulfanyl-1,2,3,4-tetrahydroisoquinoline CAS Name: 5-[(4-nitrophenyl)thio]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 5-(4-nitrophenyl)sulfanyl-1,2,3,4-tetrahydroisoquinoline Traditional Name: 5-[(4-nitrophenyl)thio]-1,2,3,4-tetrahydroisoquinoline Formula: C15H14N2O2S MolecularWeight: 286.34886

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC2=C1C(=CC=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CNCC2=C1C(=CC=C2)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O2S/c18-17(19)12-4-6-13(7-5-12)20-15-3-1-2-11-10-16-9-8-14(11)15/h1-7,16H,8-10H2