[2-[2-cyanopropan-2-yl(methyl)amino]-2-oxidanylidene-ethyl] anthracene-9-carboxylate

Systemtic Name: [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxidanylidene-ethyl] anthracene-9-carboxylate Openeye Name: [2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-oxo-ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[2-cyanopropan-2-yl(methyl)amino]-2-oxoethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-[(1-cyano-1-methyl-ethyl)-methyl-amino]-2-keto-ethyl] ester Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)N(C)C(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

Isomeric SMILES

CC(C)(C#N)N(C)C(=O)COC(=O)C1=C2C=CC=CC2=CC3=CC=CC=C31

InChI

InChI=1S/C22H20N2O3/c1-22(2,14-23)24(3)19(25)13-27-21(26)20-17-10-6-4-8-15(17)12-16-9-5-7-11-18(16)20/h4-12H,13H2,1-3H3