N-[3-(aminomethyl)-4-oxidanyl-1-oxidanylidene-butan-2-yl]-6-(4-hydroxyphenyl)hexanamide

Systemtic Name: N-[3-(aminomethyl)-4-oxidanyl-1-oxidanylidene-butan-2-yl]-6-(4-hydroxyphenyl)hexanamide Openeye Name: N-[2-(aminomethyl)-1-formyl-3-hydroxy-propyl]-6-(4-hydroxyphenyl)hexanamide CAS Name: N-[3-(aminomethyl)-4-hydroxy-1-oxobutan-2-yl]-6-(4-hydroxyphenyl)hexanamide IUPAC Name: N-[3-(aminomethyl)-4-hydroxy-1-oxobutan-2-yl]-6-(4-hydroxyphenyl)hexanamide Traditional Name: N-[2-(aminomethyl)-1-formyl-3-hydroxy-propyl]-6-(4-hydroxyphenyl)hexanamide Formula: C17H26N2O4 MolecularWeight: 322.39934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCCC(=O)NC(C=O)C(CN)CO)O

Isomeric SMILES

C1=CC(=CC=C1CCCCCC(=O)NC(C=O)C(CN)CO)O

InChI

InChI=1S/C17H26N2O4/c18-10-14(11-20)16(12-21)19-17(23)5-3-1-2-4-13-6-8-15(22)9-7-13/h6-9,12,14,16,20,22H,1-5,10-11,18H2,(H,19,23)