N-[2-(diethylamino)-2-oxidanylidene-ethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-(diethylamino)-2-oxidanylidene-ethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[2-(diethylamino)-2-oxo-ethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethyl-pyrazole-4-carboxamide CAS Name: N-[2-(diethylamino)-2-oxoethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[2-(diethylamino)-2-oxoethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethylpyrazole-4-carboxamide Traditional Name: N-[2-(diethylamino)-2-keto-ethyl]-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N,1-dimethyl-pyrazole-4-carboxamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN(C)C(=O)C1=CN(N=C1C2=CC3=C(C=C2)OCCCO3)C

Isomeric SMILES

CCN(CC)C(=O)CN(C)C(=O)C1=CN(N=C1C2=CC3=C(C=C2)OCCCO3)C

InChI

InChI=1S/C21H28N4O4/c1-5-25(6-2)19(26)14-23(3)21(27)16-13-24(4)22-20(16)15-8-9-17-18(12-15)29-11-7-10-28-17/h8-9,12-13H,5-7,10-11,14H2,1-4H3