hexanamide; O1-methyl O4-[4-(2-morpholin-4-ylethoxy)phenyl] (E)-but-2-enedioate; hydrate

Systemtic Name: hexanamide; O1-methyl O4-[4-(2-morpholin-4-ylethoxy)phenyl] (E)-but-2-enedioate; hydrate Openeye Name: hexanamide; O1-methyl O4-[4-(2-morpholinoethoxy)phenyl] (E)-but-2-enedioate; hydrate CAS Name: (E)-2-butenedioic acid O1-methyl ester O4-[4-[2-(4-morpholinyl)ethoxy]phenyl] ester; hexanamide; hydrate IUPAC Name: hexanamide; 1-O-methyl 4-O-[4-(2-morpholin-4-ylethoxy)phenyl] (E)-but-2-enedioate; hydrate Traditional Name: (E)-but-2-enedioic acid O1-methyl ester O4-[4-(2-morpholinoethoxy)phenyl] ester; hexanamide; hydrate Formula: C23H36N2O8 MolecularWeight: 468.54054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N.COC(=O)C=CC(=O)OC1=CC=C(C=C1)OCCN2CCOCC2.O

Isomeric SMILES

CCCCCC(=O)N.COC(=O)/C=C/C(=O)OC1=CC=C(C=C1)OCCN2CCOCC2.O

InChI

InChI=1S/C17H21NO6.C6H13NO.H2O/c1-21-16(19)6-7-17(20)24-15-4-2-14(3-5-15)23-13-10-18-8-11-22-12-9-18;1-2-3-4-5-6(7)8;/h2-7H,8-13H2,1H3;2-5H2,1H3,(H2,7,8);1H2/b7-6+;;