ethyl 2-[(3-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate

Systemtic Name: ethyl 2-[(3-methoxyphenyl)carbonylamino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate Openeye Name: ethyl 2-[(3-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxy-pentanoate CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoic acid ethyl ester IUPAC Name: ethyl 2-[(3-methoxybenzoyl)amino]-5-(4-methoxyphenyl)sulfonyl-2-phenoxypentanoate Traditional Name: 2-(m-anisoylamino)-5-(4-methoxyphenyl)sulfonyl-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(=CC=C2)OC)OC3=CC=CC=C3

Isomeric SMILES

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

InChI

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