2-azanyl-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(pyridin-3-ylmethyl)piperidin-2-yl]phenol

Systemtic Name: 2-azanyl-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(pyridin-3-ylmethyl)piperidin-2-yl]phenol Openeye Name: 2-amino-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(3-pyridylmethyl)-2-piperidyl]phenol CAS Name: 2-amino-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(3-pyridinylmethyl)-2-piperidinyl]phenol IUPAC Name: 2-amino-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(pyridin-3-ylmethyl)piperidin-2-yl]phenol Traditional Name: 2-amino-4-[(2R,3S,4S)-4-(2-bromophenyl)-3-nitro-1-(3-pyridylmethyl)-2-piperidyl]phenol Formula: C23H23BrN4O3 MolecularWeight: 483.35772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(C1C2=CC=CC=C2Br)[N+](=O)[O-])C3=CC(=C(C=C3)O)N)CC4=CN=CC=C4

Isomeric SMILES

C1CN([C@@H]([C@H]([C@@H]1C2=CC=CC=C2Br)[N+](=O)[O-])C3=CC(=C(C=C3)O)N)CC4=CN=CC=C4

InChI

InChI=1S/C23H23BrN4O3/c24-19-6-2-1-5-17(19)18-9-11-27(14-15-4-3-10-26-13-15)22(23(18)28(30)31)16-7-8-21(29)20(25)12-16/h1-8,10,12-13,18,22-23,29H,9,11,14,25H2/t18-,22+,23-/m0/s1