methyl 4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxidanylidene-pyrazolidin-1-yl]benzoate

Systemtic Name: methyl 4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxidanylidene-pyrazolidin-1-yl]benzoate Openeye Name: methyl 4-[5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazin-1-yl]propyl]-3-oxo-pyrazolidin-1-yl]benzoate CAS Name: 4-[5-methyl-2-[3-[4-(4-methyl-2-pyridinyl)-1-piperazinyl]propyl]-3-oxo-1-pyrazolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-methyl-2-[3-[4-(4-methylpyridin-2-yl)piperazin-1-yl]propyl]-3-oxopyrazolidin-1-yl]benzoate Traditional Name: 4-[3-keto-5-methyl-2-[3-[4-(4-methyl-2-pyridyl)piperazino]propyl]pyrazolidin-1-yl]benzoic acid methyl ester Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)N(N1C2=CC=C(C=C2)C(=O)OC)CCCN3CCN(CC3)C4=NC=CC(=C4)C

Isomeric SMILES

CC1CC(=O)N(N1C2=CC=C(C=C2)C(=O)OC)CCCN3CCN(CC3)C4=NC=CC(=C4)C

InChI

InChI=1S/C25H33N5O3/c1-19-9-10-26-23(17-19)28-15-13-27(14-16-28)11-4-12-29-24(31)18-20(2)30(29)22-7-5-21(6-8-22)25(32)33-3/h5-10,17,20H,4,11-16,18H2,1-3H3