ethyl 2-[(4-fluorophenyl)sulfonyl-(3-methylbutyl)amino]-3-methyl-pentanoate

Systemtic Name: ethyl 2-[(4-fluorophenyl)sulfonyl-(3-methylbutyl)amino]-3-methyl-pentanoate Openeye Name: ethyl 2-[(4-fluorophenyl)sulfonyl-isopentyl-amino]-3-methyl-pentanoate CAS Name: 2-[(4-fluorophenyl)sulfonyl-(3-methylbutyl)amino]-3-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[(4-fluorophenyl)sulfonyl-(3-methylbutyl)amino]-3-methylpentanoate Traditional Name: 2-[(4-fluorophenyl)sulfonyl-isoamyl-amino]-3-methyl-valeric acid ethyl ester Formula: C19H30FNO4S MolecularWeight: 387.509203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC)N(CCC(C)C)S(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CCC(C)C(C(=O)OCC)N(CCC(C)C)S(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C19H30FNO4S/c1-6-15(5)18(19(22)25-7-2)21(13-12-14(3)4)26(23,24)17-10-8-16(20)9-11-17/h8-11,14-15,18H,6-7,12-13H2,1-5H3