methyl 2-[(4-butoxyphenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(4-butoxyphenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(4-butoxyphenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[(4-butoxyphenyl)sulfonylamino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(4-butoxyphenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[(4-butoxyphenyl)sulfonylamino]-3-phenyl-propionic acid methyl ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H25NO5S/c1-3-4-14-26-17-10-12-18(13-11-17)27(23,24)21-19(20(22)25-2)15-16-8-6-5-7-9-16/h5-13,19,21H,3-4,14-15H2,1-2H3