[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: (2S)-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=C2CC(CCC2=NC3=CC=CC=C31)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=C2C[C@H](CCC2=NC3=CC=CC=C31)C

InChI

InChI=1S/C21H25N3O4/c1-3-10-22-21(27)24-18(25)12-28-20(26)19-14-6-4-5-7-16(14)23-17-9-8-13(2)11-15(17)19/h4-7,13H,3,8-12H2,1-2H3,(H2,22,24,25,27)/t13-/m0/s1