1-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(phenylmethyl)pyrazol-4-yl]-N-methoxy-methanimine

Systemtic Name: 1-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(phenylmethyl)pyrazol-4-yl]-N-methoxy-methanimine Openeye Name: 1-[1-benzyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrazol-4-yl]-N-methoxy-methanimine CAS Name: 1-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(phenylmethyl)-4-pyrazolyl]-N-methoxymethanimine IUPAC Name: 1-[1-benzyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrazol-4-yl]-N-methoxymethanimine Traditional Name: (E)-[1-benzyl-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrazol-4-yl]methylene-methoxy-amine Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CON=CC1=CN(N=C1C2=CC3=C(C=C2)OCCCO3)CC4=CC=CC=C4

Isomeric SMILES

CO/N=C/C1=CN(N=C1C2=CC3=C(C=C2)OCCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C21H21N3O3/c1-25-22-13-18-15-24(14-16-6-3-2-4-7-16)23-21(18)17-8-9-19-20(12-17)27-11-5-10-26-19/h2-4,6-9,12-13,15H,5,10-11,14H2,1H3/b22-13+