methyl 2-[2-[(4-butoxyphenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[2-[(4-butoxyphenyl)sulfonylamino]ethanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[2-[(4-butoxyphenyl)sulfonylamino]acetyl]amino]-4-methyl-pentanoate CAS Name: 2-[[2-[(4-butoxyphenyl)sulfonylamino]-1-oxoethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[2-[(4-butoxyphenyl)sulfonylamino]acetyl]amino]-4-methylpentanoate Traditional Name: 2-[[2-[(4-butoxyphenyl)sulfonylamino]acetyl]amino]-4-methyl-valeric acid methyl ester Formula: C19H30N2O6S MolecularWeight: 414.5163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(CC(C)C)C(=O)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC(=O)NC(CC(C)C)C(=O)OC

InChI

InChI=1S/C19H30N2O6S/c1-5-6-11-27-15-7-9-16(10-8-15)28(24,25)20-13-18(22)21-17(12-14(2)3)19(23)26-4/h7-10,14,17,20H,5-6,11-13H2,1-4H3,(H,21,22)