[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] anthracene-9-carboxylate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] anthracene-9-carboxylate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3/c1-15(2)11-12-23-20(24)14-26-22(25)21-18-9-5-3-7-16(18)13-17-8-4-6-10-19(17)21/h3-10,13,15H,11-12,14H2,1-2H3,(H,23,24)