[3-bromanyl-4-[(3-nitrophenyl)methoxy]phenyl]-piperidin-1-yl-methanethione

Systemtic Name: [3-bromanyl-4-[(3-nitrophenyl)methoxy]phenyl]-piperidin-1-yl-methanethione Openeye Name: [3-bromo-4-[(3-nitrophenyl)methoxy]phenyl]-(1-piperidyl)methanethione CAS Name: [3-bromo-4-[(3-nitrophenyl)methoxy]phenyl]-(1-piperidinyl)methanethione IUPAC Name: [3-bromo-4-[(3-nitrophenyl)methoxy]phenyl]-piperidin-1-ylmethanethione Traditional Name: [3-bromo-4-(3-nitrobenzyl)oxy-phenyl]-piperidino-methanethione Formula: C19H19BrN2O3S MolecularWeight: 435.33476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C19H19BrN2O3S/c20-17-12-15(19(26)21-9-2-1-3-10-21)7-8-18(17)25-13-14-5-4-6-16(11-14)22(23)24/h4-8,11-12H,1-3,9-10,13H2