diethyl 2-acetamido-2-[(8,8-dimethyl-3-nitro-6,7-dihydro-5H-naphthalen-2-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(8,8-dimethyl-3-nitro-6,7-dihydro-5H-naphthalen-2-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(4,4-dimethyl-7-nitro-tetralin-6-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(8,8-dimethyl-3-nitro-6,7-dihydro-5H-naphthalen-2-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(8,8-dimethyl-3-nitro-6,7-dihydro-5H-naphthalen-2-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(4,4-dimethyl-7-nitro-tetralin-6-yl)methyl]malonic acid diethyl ester Formula: C22H30N2O7 MolecularWeight: 434.4828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C(C=C2CCCC(C2=C1)(C)C)[N+](=O)[O-])(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C(C=C2CCCC(C2=C1)(C)C)[N+](=O)[O-])(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C22H30N2O7/c1-6-30-19(26)22(23-14(3)25,20(27)31-7-2)13-16-11-17-15(12-18(16)24(28)29)9-8-10-21(17,4)5/h11-12H,6-10,13H2,1-5H3,(H,23,25)