[2-oxidanylidene-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] 3-methyl-4-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] 3-methyl-4-nitro-benzoate Openeye Name: [2-oxo-2-(1-tetralin-6-ylethylamino)ethyl] 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid [2-oxo-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethylamino]ethyl] 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid [2-keto-2-(1-tetralin-6-ylethylamino)ethyl] ester Formula: C22H24N2O5 MolecularWeight: 396.43636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCC(=O)NC(C)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCC(=O)NC(C)C2=CC3=C(CCCC3)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O5/c1-14-11-19(9-10-20(14)24(27)28)22(26)29-13-21(25)23-15(2)17-8-7-16-5-3-4-6-18(16)12-17/h7-12,15H,3-6,13H2,1-2H3,(H,23,25)