2-[4-(morpholin-4-ylmethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one

Systemtic Name: 2-[4-(morpholin-4-ylmethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one Openeye Name: 2-[4-(morpholinomethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one CAS Name: 2-[4-(4-morpholinylmethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one IUPAC Name: 2-[4-(morpholin-4-ylmethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one Traditional Name: 2-[4-(morpholinomethyl)phenyl]-4-(4-phenoxybutyl)-1,2,4-triazol-3-one Formula: C23H28N4O3 MolecularWeight: 408.49342

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC=C(C=C2)N3C(=O)N(C=N3)CCCCOC4=CC=CC=C4

Isomeric SMILES

C1COCCN1CC2=CC=C(C=C2)N3C(=O)N(C=N3)CCCCOC4=CC=CC=C4

InChI

InChI=1S/C23H28N4O3/c28-23-26(12-4-5-15-30-22-6-2-1-3-7-22)19-24-27(23)21-10-8-20(9-11-21)18-25-13-16-29-17-14-25/h1-3,6-11,19H,4-5,12-18H2