4-[[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]amino]pentyl N-butylcarbamate

Systemtic Name: 4-[[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]amino]pentyl N-butylcarbamate Openeye Name: 4-[[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]pentyl N-butylcarbamate CAS Name: N-butylcarbamic acid 4-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]pentyl ester IUPAC Name: 4-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]pentyl N-butylcarbamate Traditional Name: N-butylcarbamic acid 4-[[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]pentyl ester Formula: C18H30N2O5 MolecularWeight: 354.4412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OCCCC(C)NCC(C1=CC(=C(C=C1)O)O)O

Isomeric SMILES

CCCCNC(=O)OCCCC(C)NCC(C1=CC(=C(C=C1)O)O)O

InChI

InChI=1S/C18H30N2O5/c1-3-4-9-19-18(24)25-10-5-6-13(2)20-12-17(23)14-7-8-15(21)16(22)11-14/h7-8,11,13,17,20-23H,3-6,9-10,12H2,1-2H3,(H,19,24)