1-(2-bromophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)pyrrole-3-carbonitrile

Systemtic Name: 1-(2-bromophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]decan-8-ylcarbonyl)pyrrole-3-carbonitrile Openeye Name: 1-(2-bromophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrole-3-carbonitrile CAS Name: 1-(2-bromophenyl)-2-[1,4-dioxa-8-azaspiro[4.5]decan-8-yl(oxo)methyl]-3-pyrrolecarbonitrile IUPAC Name: 1-(2-bromophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrole-3-carbonitrile Traditional Name: 1-(2-bromophenyl)-2-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyrrole-3-carbonitrile Formula: C19H18BrN3O3 MolecularWeight: 416.26852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C(=O)C3=C(C=CN3C4=CC=CC=C4Br)C#N

Isomeric SMILES

C1CN(CCC12OCCO2)C(=O)C3=C(C=CN3C4=CC=CC=C4Br)C#N

InChI

InChI=1S/C19H18BrN3O3/c20-15-3-1-2-4-16(15)23-8-5-14(13-21)17(23)18(24)22-9-6-19(7-10-22)25-11-12-26-19/h1-5,8H,6-7,9-12H2