ethyl 2-[(6-chloranylnaphthalen-2-yl)sulfonyl-piperazin-2-ylcarbonyl-amino]ethanoate

Systemtic Name: ethyl 2-[(6-chloranylnaphthalen-2-yl)sulfonyl-piperazin-2-ylcarbonyl-amino]ethanoate Openeye Name: ethyl 2-[(6-chloro-2-naphthyl)sulfonyl-(piperazine-2-carbonyl)amino]acetate CAS Name: 2-[(6-chloro-2-naphthalenyl)sulfonyl-[oxo(2-piperazinyl)methyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(6-chloronaphthalen-2-yl)sulfonyl-(piperazine-2-carbonyl)amino]acetate Traditional Name: 2-[(6-chloro-2-naphthyl)sulfonyl-(piperazine-2-carbonyl)amino]acetic acid ethyl ester Formula: C19H22ClN3O5S MolecularWeight: 439.91308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C(=O)C1CNCCN1)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)CN(C(=O)C1CNCCN1)S(=O)(=O)C2=CC3=C(C=C2)C=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3O5S/c1-2-28-18(24)12-23(19(25)17-11-21-7-8-22-17)29(26,27)16-6-4-13-9-15(20)5-3-14(13)10-16/h3-6,9-10,17,21-22H,2,7-8,11-12H2,1H3