5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carbaldehyde

Systemtic Name: 5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carbaldehyde Openeye Name: 5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carbaldehyde CAS Name: 5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carboxaldehyde IUPAC Name: 5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carbaldehyde Traditional Name: 5-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-1-methyl-1,2,4-triazole-3-carbaldehyde Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)C=O)NCCCOC2=CC=CC(=C2)CN(C)C

Isomeric SMILES

CN1C(=NC(=N1)C=O)NCCCOC2=CC=CC(=C2)CN(C)C

InChI

InChI=1S/C16H23N5O2/c1-20(2)11-13-6-4-7-14(10-13)23-9-5-8-17-16-18-15(12-22)19-21(16)3/h4,6-7,10,12H,5,8-9,11H2,1-3H3,(H,17,18,19)