ethyl 2-[(4-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate

Systemtic Name: ethyl 2-[(4-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate Openeye Name: ethyl 2-[(4-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate CAS Name: 2-[[(4-methoxyphenyl)-oxomethyl]amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoate Traditional Name: 5-(4-methoxyphenyl)sulfonyl-2-(p-anisoylamino)-2-phenoxy-valeric acid ethyl ester Formula: C28H31NO8S MolecularWeight: 541.61264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCS(=O)(=O)C1=CC=C(C=C1)OC)(NC(=O)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CCCS(=O)(=O)C1=CC=C(C=C1)OC)(NC(=O)C2=CC=C(C=C2)OC)OC3=CC=CC=C3

InChI

InChI=1S/C28H31NO8S/c1-4-36-27(31)28(37-24-9-6-5-7-10-24,29-26(30)21-11-13-22(34-2)14-12-21)19-8-20-38(32,33)25-17-15-23(35-3)16-18-25/h5-7,9-18H,4,8,19-20H2,1-3H3,(H,29,30)