[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 1,2-dihydroacenaphthylene-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 1,2-dihydroacenaphthylene-5-carboxylate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 1,2-dihydroacenaphthylene-5-carboxylate CAS Name: 1,2-dihydroacenaphthylene-5-carboxylic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 1,2-dihydroacenaphthylene-5-carboxylate Traditional Name: acenaphthene-5-carboxylic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)COC(=O)C1=C2C=CC=C3C2=C(CC3)C=C1

Isomeric SMILES

CC(C)OCCCNC(=O)COC(=O)C1=C2C=CC=C3C2=C(CC3)C=C1

InChI

InChI=1S/C21H25NO4/c1-14(2)25-12-4-11-22-19(23)13-26-21(24)18-10-9-16-8-7-15-5-3-6-17(18)20(15)16/h3,5-6,9-10,14H,4,7-8,11-13H2,1-2H3,(H,22,23)