[2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 4-(2-methoxyethylamino)-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 4-(2-methoxyethylamino)-3-nitro-benzoate Openeye Name: (2-oxo-2-tetralin-6-yl-ethyl) 4-(2-methoxyethylamino)-3-nitro-benzoate CAS Name: 4-(2-methoxyethylamino)-3-nitrobenzoic acid [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 4-(2-methoxyethylamino)-3-nitrobenzoate Traditional Name: 4-(2-methoxyethylamino)-3-nitro-benzoic acid (2-keto-2-tetralin-6-yl-ethyl) ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O6/c1-29-11-10-23-19-9-8-18(13-20(19)24(27)28)22(26)30-14-21(25)17-7-6-15-4-2-3-5-16(15)12-17/h6-9,12-13,23H,2-5,10-11,14H2,1H3