butyl 2-(4-azanylbutanoylamino)-3-[3,4-bis(oxidanyl)phenyl]propanoate

Systemtic Name: butyl 2-(4-azanylbutanoylamino)-3-[3,4-bis(oxidanyl)phenyl]propanoate Openeye Name: butyl 2-(4-aminobutanoylamino)-3-(3,4-dihydroxyphenyl)propanoate CAS Name: 2-[(4-amino-1-oxobutyl)amino]-3-(3,4-dihydroxyphenyl)propanoic acid butyl ester IUPAC Name: butyl 2-(4-aminobutanoylamino)-3-(3,4-dihydroxyphenyl)propanoate Traditional Name: 2-(4-aminobutanoylamino)-3-(3,4-dihydroxyphenyl)propionic acid butyl ester Formula: C17H26N2O5 MolecularWeight: 338.39874

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(CC1=CC(=C(C=C1)O)O)NC(=O)CCCN

Isomeric SMILES

CCCCOC(=O)C(CC1=CC(=C(C=C1)O)O)NC(=O)CCCN

InChI

InChI=1S/C17H26N2O5/c1-2-3-9-24-17(23)13(19-16(22)5-4-8-18)10-12-6-7-14(20)15(21)11-12/h6-7,11,13,20-21H,2-5,8-10,18H2,1H3,(H,19,22)