ethyl 2-[4-[1-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-4-pyridin-3-yl-butyl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[1-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-4-pyridin-3-yl-butyl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[1-[(4-chlorophenyl)sulfonyl-ethoxycarbonyl-amino]-4-(3-pyridyl)butyl]phenoxy]acetate CAS Name: 2-[4-[1-[(4-chlorophenyl)sulfonyl-ethoxycarbonylamino]-4-(3-pyridinyl)butyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[1-[(4-chlorophenyl)sulfonyl-ethoxycarbonylamino]-4-pyridin-3-ylbutyl]phenoxy]acetate Traditional Name: 2-[4-[1-[carbethoxy-(4-chlorophenyl)sulfonyl-amino]-4-(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)C(CCCC2=CN=CC=C2)N(C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)C(CCCC2=CN=CC=C2)N(C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C28H31ClN2O7S/c1-3-36-27(32)20-38-24-14-10-22(11-15-24)26(9-5-7-21-8-6-18-30-19-21)31(28(33)37-4-2)39(34,35)25-16-12-23(29)13-17-25/h6,8,10-19,26H,3-5,7,9,20H2,1-2H3