2-[5-(diphenylmethyl)-4-[(2-methoxy-5-nitro-phenyl)methylamino]pyrrolidin-3-yl]ethanol

Systemtic Name: 2-[5-(diphenylmethyl)-4-[(2-methoxy-5-nitro-phenyl)methylamino]pyrrolidin-3-yl]ethanol Openeye Name: 2-[5-benzhydryl-4-[(2-methoxy-5-nitro-phenyl)methylamino]pyrrolidin-3-yl]ethanol CAS Name: 2-[5-(diphenylmethyl)-4-[(2-methoxy-5-nitrophenyl)methylamino]-3-pyrrolidinyl]ethanol IUPAC Name: 2-[5-benzhydryl-4-[(2-methoxy-5-nitrophenyl)methylamino]pyrrolidin-3-yl]ethanol Traditional Name: 2-[5-benzhydryl-4-[(2-methoxy-5-nitro-benzyl)amino]pyrrolidin-3-yl]ethanol Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2C(CNC2C(C3=CC=CC=C3)C4=CC=CC=C4)CCO

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CNC2C(CNC2C(C3=CC=CC=C3)C4=CC=CC=C4)CCO

InChI

InChI=1S/C27H31N3O4/c1-34-24-13-12-23(30(32)33)16-22(24)18-28-26-21(14-15-31)17-29-27(26)25(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-13,16,21,25-29,31H,14-15,17-18H2,1H3