ethyl 4-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[(2-methoxyphenyl)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-(4-o-anisylpiperazino)sulfonylbenzoic acid ethyl ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC=C3OC

InChI

InChI=1S/C21H26N2O5S/c1-3-28-21(24)17-8-10-19(11-9-17)29(25,26)23-14-12-22(13-15-23)16-18-6-4-5-7-20(18)27-2/h4-11H,3,12-16H2,1-2H3