N-[(3-methoxyphenyl)methyl]-3-[1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidin-3-yl]propanamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-[1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidin-3-yl]propanamide Openeye Name: N-[(3-methoxyphenyl)methyl]-3-[1-[3-(1,2,4-triazol-1-yl)propanoyl]-3-piperidyl]propanamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-[1-[1-oxo-3-(1,2,4-triazol-1-yl)propyl]-3-piperidinyl]propanamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-[1-[3-(1,2,4-triazol-1-yl)propanoyl]piperidin-3-yl]propanamide Traditional Name: N-m-anisyl-3-[1-[3-(1,2,4-triazol-1-yl)propanoyl]-3-piperidyl]propionamide Formula: C21H29N5O3 MolecularWeight: 399.48666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCC2CCCN(C2)C(=O)CCN3C=NC=N3

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CCC2CCCN(C2)C(=O)CCN3C=NC=N3

InChI

InChI=1S/C21H29N5O3/c1-29-19-6-2-4-18(12-19)13-23-20(27)8-7-17-5-3-10-25(14-17)21(28)9-11-26-16-22-15-24-26/h2,4,6,12,15-17H,3,5,7-11,13-14H2,1H3,(H,23,27)