methyl 3-azanyl-4-[butyl-[(2-fluoranyl-5-methyl-phenyl)methyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 3-azanyl-4-[butyl-[(2-fluoranyl-5-methyl-phenyl)methyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 3-amino-4-[butyl-[(2-fluoro-5-methyl-phenyl)methyl]amino]-4-oxo-butanoate CAS Name: 3-amino-4-[butyl-[(2-fluoro-5-methylphenyl)methyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 3-amino-4-[butyl-[(2-fluoro-5-methylphenyl)methyl]amino]-4-oxobutanoate Traditional Name: 3-amino-4-[butyl-(2-fluoro-5-methyl-benzyl)amino]-4-keto-butyric acid methyl ester Formula: C17H25FN2O3 MolecularWeight: 324.390403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=C(C=CC(=C1)C)F)C(=O)C(CC(=O)OC)N

Isomeric SMILES

CCCCN(CC1=C(C=CC(=C1)C)F)C(=O)C(CC(=O)OC)N

InChI

InChI=1S/C17H25FN2O3/c1-4-5-8-20(17(22)15(19)10-16(21)23-3)11-13-9-12(2)6-7-14(13)18/h6-7,9,15H,4-5,8,10-11,19H2,1-3H3