ethyl 2-[2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]carbonylimino-5-nitro-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]carbonylimino-5-nitro-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carbonyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[[1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carbonyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[1-(4-methoxyphenyl)sulfonylprolyl]imino-5-nitro-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C23H24N4O8S2 MolecularWeight: 548.58866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=CC(=C2)[N+](=O)[O-])SC1=NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H24N4O8S2/c1-3-35-21(28)14-25-19-13-15(27(30)31)6-11-20(19)36-23(25)24-22(29)18-5-4-12-26(18)37(32,33)17-9-7-16(34-2)8-10-17/h6-11,13,18H,3-5,12,14H2,1-2H3