naphthalen-1-ylmethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: naphthalen-1-ylmethyl 4-(4-ethanoylpiperazin-1-yl)sulfonylbenzoate Openeye Name: 1-naphthylmethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate CAS Name: 4-[(4-acetyl-1-piperazinyl)sulfonyl]benzoic acid 1-naphthalenylmethyl ester IUPAC Name: naphthalen-1-ylmethyl 4-(4-acetylpiperazin-1-yl)sulfonylbenzoate Traditional Name: 4-(4-acetylpiperazino)sulfonylbenzoic acid 1-naphthylmethyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H24N2O5S/c1-18(27)25-13-15-26(16-14-25)32(29,30)22-11-9-20(10-12-22)24(28)31-17-21-7-4-6-19-5-2-3-8-23(19)21/h2-12H,13-17H2,1H3