[2,6-di(propan-2-yl)phenyl] 4-[2-(4-methylpiperazin-1-yl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: [2,6-di(propan-2-yl)phenyl] 4-[2-(4-methylpiperazin-1-yl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: (2,6-diisopropylphenyl) 4-[2-(4-methylpiperazin-1-yl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(4-methyl-1-piperazinyl)ethylamino]-4-oxobutanoic acid [2,6-di(propan-2-yl)phenyl] ester IUPAC Name: [2,6-di(propan-2-yl)phenyl] 4-[2-(4-methylpiperazin-1-yl)ethylamino]-4-oxobutanoate Traditional Name: 4-keto-4-[2-(4-methylpiperazino)ethylamino]butyric acid (2,6-diisopropylphenyl) ester Formula: C23H37N3O3 MolecularWeight: 403.55818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCC(=O)NCCN2CCN(CC2)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)OC(=O)CCC(=O)NCCN2CCN(CC2)C

InChI

InChI=1S/C23H37N3O3/c1-17(2)19-7-6-8-20(18(3)4)23(19)29-22(28)10-9-21(27)24-11-12-26-15-13-25(5)14-16-26/h6-8,17-18H,9-16H2,1-5H3,(H,24,27)