2-[2-[1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]ethyl]-3-oxidanylidene-butanoate

Systemtic Name: 2-[2-[1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]ethyl]-3-oxidanylidene-butanoate Openeye Name: 2-[2-[1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]ethyl]-3-oxo-butanoate CAS Name: 2-[2-[1-[(3,4-dimethoxyphenyl)methyl]-2-piperazinyl]ethyl]-3-oxobutanoate IUPAC Name: 2-[2-[1-[(3,4-dimethoxyphenyl)methyl]piperazin-2-yl]ethyl]-3-oxobutanoate Traditional Name: 3-keto-2-[2-(1-veratrylpiperazin-2-yl)ethyl]butyrate Formula: C19H27N2O5- MolecularWeight: 363.42808

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1CNCCN1CC2=CC(=C(C=C2)OC)OC)C(=O)[O-]

Isomeric SMILES

CC(=O)C(CCC1CNCCN1CC2=CC(=C(C=C2)OC)OC)C(=O)[O-]

InChI

InChI=1S/C19H28N2O5/c1-13(22)16(19(23)24)6-5-15-11-20-8-9-21(15)12-14-4-7-17(25-2)18(10-14)26-3/h4,7,10,15-16,20H,5-6,8-9,11-12H2,1-3H3,(H,23,24)/p-1