ethyl 2-[4-[4-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-2-pyridin-3-yl-butyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[4-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-2-pyridin-3-yl-butyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[4-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-2-(3-pyridyl)butyl]phenoxy]acetate CAS Name: 2-[4-[4-[(4-chlorophenyl)sulfonyl-ethoxycarbonylamino]-2-(3-pyridinyl)butyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[4-[(4-chlorophenyl)sulfonyl-ethoxycarbonylamino]-2-pyridin-3-ylbutyl]phenoxy]acetate Traditional Name: 2-[4-[4-[carbethoxy-(4-chlorophenyl)sulfonyl-amino]-2-(3-pyridyl)butyl]phenoxy]acetic acid ethyl ester Formula: C28H31ClN2O7S MolecularWeight: 575.07294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)CC(CCN(C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Cl)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)CC(CCN(C(=O)OCC)S(=O)(=O)C2=CC=C(C=C2)Cl)C3=CN=CC=C3

InChI

InChI=1S/C28H31ClN2O7S/c1-3-36-27(32)20-38-25-11-7-21(8-12-25)18-22(23-6-5-16-30-19-23)15-17-31(28(33)37-4-2)39(34,35)26-13-9-24(29)10-14-26/h5-14,16,19,22H,3-4,15,17-18,20H2,1-2H3