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

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 9H-xanthene-9-carboxylate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 9H-xanthene-9-carboxylate CAS Name: 9H-xanthene-9-carboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 9H-xanthene-9-carboxylate Traditional Name: 9H-xanthene-9-carboxylic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)COC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13

Isomeric SMILES

CC(C)CCNC(=O)COC(=O)C1C2=CC=CC=C2OC3=CC=CC=C13

InChI

InChI=1S/C21H23NO4/c1-14(2)11-12-22-19(23)13-25-21(24)20-15-7-3-5-9-17(15)26-18-10-6-4-8-16(18)20/h3-10,14,20H,11-13H2,1-2H3,(H,22,23)