[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OCC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC2=C(C3=C(CCCC3)N=C2C=C1)C(=O)OCC(=O)NCCC(C)C

InChI

InChI=1S/C22H28N2O3/c1-14(2)10-11-23-20(25)13-27-22(26)21-16-6-4-5-7-18(16)24-19-9-8-15(3)12-17(19)21/h8-9,12,14H,4-7,10-11,13H2,1-3H3,(H,23,25)