N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-oxidanyl-butyl]propanamide hydrate

Systemtic Name: N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-oxidanyl-butyl]propanamide hydrate Openeye Name: N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-hydroxy-butyl]propanamide hydrate CAS Name: N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-hydroxybutyl]propanamide hydrate IUPAC Name: N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-hydroxybutyl]propanamide hydrate Traditional Name: N-[4-[2-(4-acetamidophenoxy)ethylamino]-3-hydroxy-butyl]propionamide hydrate Formula: C17H29N3O5 MolecularWeight: 355.42926

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCC(CNCCOC1=CC=C(C=C1)NC(=O)C)O.O

Isomeric SMILES

CCC(=O)NCCC(CNCCOC1=CC=C(C=C1)NC(=O)C)O.O

InChI

InChI=1S/C17H27N3O4.H2O/c1-3-17(23)19-9-8-15(22)12-18-10-11-24-16-6-4-14(5-7-16)20-13(2)21;/h4-7,15,18,22H,3,8-12H2,1-2H3,(H,19,23)(H,20,21);1H2