[2-(cyclooctylamino)-2-oxidanylidene-ethyl] 2-[4-[(4-ethoxyphenyl)sulfonyl-methyl-amino]phenoxy]ethanoate

Systemtic Name: [2-(cyclooctylamino)-2-oxidanylidene-ethyl] 2-[4-[(4-ethoxyphenyl)sulfonyl-methyl-amino]phenoxy]ethanoate Openeye Name: [2-(cyclooctylamino)-2-oxo-ethyl] 2-[4-[(4-ethoxyphenyl)sulfonyl-methyl-amino]phenoxy]acetate CAS Name: 2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]acetic acid [2-(cyclooctylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclooctylamino)-2-oxoethyl] 2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]acetate Traditional Name: 2-[4-[methyl(p-phenetylsulfonyl)amino]phenoxy]acetic acid [2-(cyclooctylamino)-2-keto-ethyl] ester Formula: C27H36N2O7S MolecularWeight: 532.64894

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)OCC(=O)NC3CCCCCCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)OCC(=O)NC3CCCCCCC3

InChI

InChI=1S/C27H36N2O7S/c1-3-34-23-15-17-25(18-16-23)37(32,33)29(2)22-11-13-24(14-12-22)35-20-27(31)36-19-26(30)28-21-9-7-5-4-6-8-10-21/h11-18,21H,3-10,19-20H2,1-2H3,(H,28,30)