1-[bromanyl-[2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]amino]-3-(3-nitrophenyl)propan-2-one

Systemtic Name: 1-[bromanyl-[2-(3-oxidanylpyrrolidin-1-yl)-1-phenyl-ethyl]amino]-3-(3-nitrophenyl)propan-2-one Openeye Name: 1-[bromo-[2-(3-hydroxypyrrolidin-1-yl)-1-phenyl-ethyl]amino]-3-(3-nitrophenyl)propan-2-one CAS Name: 1-[bromo-[2-(3-hydroxy-1-pyrrolidinyl)-1-phenylethyl]amino]-3-(3-nitrophenyl)-2-propanone IUPAC Name: 1-[bromo-[2-(3-hydroxypyrrolidin-1-yl)-1-phenylethyl]amino]-3-(3-nitrophenyl)propan-2-one Traditional Name: 1-[bromo-[2-(3-hydroxypyrrolidino)-1-phenyl-ethyl]amino]-3-(3-nitrophenyl)acetone Formula: C21H24BrN3O4 MolecularWeight: 462.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1O)CC(C2=CC=CC=C2)N(CC(=O)CC3=CC(=CC=C3)[N+](=O)[O-])Br

Isomeric SMILES

C1CN(CC1O)CC(C2=CC=CC=C2)N(CC(=O)CC3=CC(=CC=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C21H24BrN3O4/c22-24(14-20(27)12-16-5-4-8-18(11-16)25(28)29)21(17-6-2-1-3-7-17)15-23-10-9-19(26)13-23/h1-8,11,19,21,26H,9-10,12-15H2