N-[(3,4-dichlorophenyl)methyl]-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]morpholine-4-carboxamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]morpholine-4-carboxamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]morpholine-4-carboxamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]-4-morpholinecarboxamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]morpholine-4-carboxamide Traditional Name: N-(3,4-dichlorobenzyl)-2-[[4-(1,2,4-triazol-1-yl)phenoxy]methyl]morpholine-4-carboxamide Formula: C21H21Cl2N5O3 MolecularWeight: 462.32914

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CN1C(=O)NCC2=CC(=C(C=C2)Cl)Cl)COC3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

C1COC(CN1C(=O)NCC2=CC(=C(C=C2)Cl)Cl)COC3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C21H21Cl2N5O3/c22-19-6-1-15(9-20(19)23)10-25-21(29)27-7-8-30-18(11-27)12-31-17-4-2-16(3-5-17)28-14-24-13-26-28/h1-6,9,13-14,18H,7-8,10-12H2,(H,25,29)