3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N,1-dimethyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N,1-dimethyl-pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(2-methoxy-5-methyl-phenyl)methyl]-N,1-dimethyl-pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(2-methoxy-5-methylphenyl)methyl]-N,1-dimethyl-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[(2-methoxy-5-methylphenyl)methyl]-N,1-dimethylpyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(2-methoxy-5-methyl-benzyl)-N,1-dimethyl-pyrazole-4-carboxamide Formula: C24H27N3O4 MolecularWeight: 421.48888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CN(C)C(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CN(C)C(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C24H27N3O4/c1-16-6-8-20(29-4)18(12-16)14-26(2)24(28)19-15-27(3)25-23(19)17-7-9-21-22(13-17)31-11-5-10-30-21/h6-9,12-13,15H,5,10-11,14H2,1-4H3