[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] anthracene-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] anthracene-9-carboxylate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C27H25NO3 MolecularWeight: 411.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)C(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C27H25NO3/c1-19(2)28(17-20-10-4-3-5-11-20)25(29)18-31-27(30)26-23-14-8-6-12-21(23)16-22-13-7-9-15-24(22)26/h3-16,19H,17-18H2,1-2H3