[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-propoxybenzoate

Systemtic Name: [2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-propoxybenzoate Openeye Name: [2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxo-ethyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-[4-(2,3-dimethylphenyl)piperazino]-2-keto-ethyl] ester Formula: C24H30N2O4 MolecularWeight: 410.506

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C24H30N2O4/c1-4-16-29-21-10-8-20(9-11-21)24(28)30-17-23(27)26-14-12-25(13-15-26)22-7-5-6-18(2)19(22)3/h5-11H,4,12-17H2,1-3H3