[2-[[4-(diethylamino)phenyl]amino]-2-oxidanylidene-ethyl] 2-methyl-6-nitro-benzoate

Systemtic Name: [2-[[4-(diethylamino)phenyl]amino]-2-oxidanylidene-ethyl] 2-methyl-6-nitro-benzoate Openeye Name: [2-[4-(diethylamino)anilino]-2-oxo-ethyl] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [2-[4-(diethylamino)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(diethylamino)anilino]-2-oxoethyl] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [2-[4-(diethylamino)anilino]-2-keto-ethyl] ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)NC(=O)COC(=O)C2=C(C=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O5/c1-4-22(5-2)16-11-9-15(10-12-16)21-18(24)13-28-20(25)19-14(3)7-6-8-17(19)23(26)27/h6-12H,4-5,13H2,1-3H3,(H,21,24)