ethyl 2-[4-[5-(dimethylamino)naphthalen-1-yl]sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[5-(dimethylamino)naphthalen-1-yl]sulfonylpiperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[[5-(dimethylamino)-1-naphthyl]sulfonyl]piperazin-1-yl]acetate CAS Name: 2-[4-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[5-(dimethylamino)naphthalen-1-yl]sulfonylpiperazin-1-yl]acetate Traditional Name: 2-(4-naphthionylpiperazino)acetic acid ethyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC3=C2C=CC=C3N(C)C

InChI

InChI=1S/C20H27N3O4S/c1-4-27-20(24)15-22-11-13-23(14-12-22)28(25,26)19-10-6-7-16-17(19)8-5-9-18(16)21(2)3/h5-10H,4,11-15H2,1-3H3