[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone

Systemtic Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone Openeye Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone CAS Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-(1-methyl-4-pyrazolyl)methanone IUPAC Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone Traditional Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-(1-methylpyrazol-4-yl)methanone Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C18H21N3O3/c1-20-12-14(11-19-20)18(22)21-7-2-4-15(21)13-5-6-16-17(10-13)24-9-3-8-23-16/h5-6,10-12,15H,2-4,7-9H2,1H3