N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenylpyrazol-4-yl)propanamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenylpyrazol-4-yl)propanamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenylpyrazol-4-yl)propanamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenyl-4-pyrazolyl)propanamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenylpyrazol-4-yl)propanamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(1-phenylpyrazol-4-yl)propionamide Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3/c1-15(17-8-9-19-20(11-17)27-14-26-19)23-21(25)10-7-16-12-22-24(13-16)18-5-3-2-4-6-18/h2-6,8-9,11-13,15H,7,10,14H2,1H3,(H,23,25)