3-[(5-bromanyl-3-nitro-pyridin-2-yl)amino]-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)oxolan-2-one

Systemtic Name: 3-[(5-bromanyl-3-nitro-pyridin-2-yl)amino]-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)oxolan-2-one Openeye Name: 3-[(5-bromo-3-nitro-2-pyridyl)amino]-5-methyl-5-tetralin-6-yl-tetrahydrofuran-2-one CAS Name: 3-[(5-bromo-3-nitro-2-pyridinyl)amino]-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-2-oxolanone IUPAC Name: 3-[(5-bromo-3-nitropyridin-2-yl)amino]-5-methyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)oxolan-2-one Traditional Name: 3-[(5-bromo-3-nitro-2-pyridyl)amino]-5-methyl-5-tetralin-6-yl-tetrahydrofuran-2-one Formula: C20H20BrN3O4 MolecularWeight: 446.2945

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NC2=NC=C(C=C2[N+](=O)[O-])Br)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1(CC(C(=O)O1)NC2=NC=C(C=C2[N+](=O)[O-])Br)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C20H20BrN3O4/c1-20(14-7-6-12-4-2-3-5-13(12)8-14)10-16(19(25)28-20)23-18-17(24(26)27)9-15(21)11-22-18/h6-9,11,16H,2-5,10H2,1H3,(H,22,23)