3-[(5-bromanyl-3-nitro-pyridin-2-yl)amino]-5-phenyl-5-propan-2-yl-oxolan-2-one

Systemtic Name: 3-[(5-bromanyl-3-nitro-pyridin-2-yl)amino]-5-phenyl-5-propan-2-yl-oxolan-2-one Openeye Name: 3-[(5-bromo-3-nitro-2-pyridyl)amino]-5-isopropyl-5-phenyl-tetrahydrofuran-2-one CAS Name: 3-[(5-bromo-3-nitro-2-pyridinyl)amino]-5-phenyl-5-propan-2-yl-2-oxolanone IUPAC Name: 3-[(5-bromo-3-nitropyridin-2-yl)amino]-5-phenyl-5-propan-2-yloxolan-2-one Traditional Name: 3-[(5-bromo-3-nitro-2-pyridyl)amino]-5-isopropyl-5-phenyl-tetrahydrofuran-2-one Formula: C18H18BrN3O4 MolecularWeight: 420.25722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(C(=O)O1)NC2=NC=C(C=C2[N+](=O)[O-])Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1(CC(C(=O)O1)NC2=NC=C(C=C2[N+](=O)[O-])Br)C3=CC=CC=C3

InChI

InChI=1S/C18H18BrN3O4/c1-11(2)18(12-6-4-3-5-7-12)9-14(17(23)26-18)21-16-15(22(24)25)8-13(19)10-20-16/h3-8,10-11,14H,9H2,1-2H3,(H,20,21)