1-[5-[4-[3-azanyl-3-(hydroxymethyl)-4-oxidanyl-butyl]phenyl]thiophen-2-yl]ethanone

Systemtic Name: 1-[5-[4-[3-azanyl-3-(hydroxymethyl)-4-oxidanyl-butyl]phenyl]thiophen-2-yl]ethanone Openeye Name: 1-[5-[4-[3-amino-4-hydroxy-3-(hydroxymethyl)butyl]phenyl]-2-thienyl]ethanone CAS Name: 1-[5-[4-[3-amino-4-hydroxy-3-(hydroxymethyl)butyl]phenyl]-2-thiophenyl]ethanone IUPAC Name: 1-[5-[4-[3-amino-4-hydroxy-3-(hydroxymethyl)butyl]phenyl]thiophen-2-yl]ethanone Traditional Name: 1-[5-[4-(3-amino-4-hydroxy-3-methylol-butyl)phenyl]-2-thienyl]ethanone Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(S1)C2=CC=C(C=C2)CCC(CO)(CO)N

Isomeric SMILES

CC(=O)C1=CC=C(S1)C2=CC=C(C=C2)CCC(CO)(CO)N

InChI

InChI=1S/C17H21NO3S/c1-12(21)15-6-7-16(22-15)14-4-2-13(3-5-14)8-9-17(18,10-19)11-20/h2-7,19-20H,8-11,18H2,1H3