methyl 2-[(4-but-2-ynoxyphenyl)sulfonyl-prop-2-ynyl-amino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-but-2-ynoxyphenyl)sulfonyl-prop-2-ynyl-amino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-but-2-ynoxyphenyl)sulfonyl-prop-2-ynyl-amino]-3-methyl-butanoate CAS Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-prop-2-ynylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-but-2-ynoxyphenyl)sulfonyl-prop-2-ynylamino]-3-methylbutanoate Traditional Name: 2-[(4-but-2-ynoxyphenyl)sulfonyl-propargyl-amino]-3-methyl-butyric acid methyl ester Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CC#C)C(C(C)C)C(=O)OC

Isomeric SMILES

CC#CCOC1=CC=C(C=C1)S(=O)(=O)N(CC#C)C(C(C)C)C(=O)OC

InChI

InChI=1S/C19H23NO5S/c1-6-8-14-25-16-9-11-17(12-10-16)26(22,23)20(13-7-2)18(15(3)4)19(21)24-5/h2,9-12,15,18H,13-14H2,1,3-5H3