4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(2-pyridylmethyl)benzamide CAS Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-N-(2-pyridylmethyl)benzamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12OCCO2)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC12OCCO2)C3=C(C=C(C=C3)C(=O)NCC4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c25-19(22-14-16-3-1-2-8-21-16)15-4-5-17(18(13-15)24(26)27)23-9-6-20(7-10-23)28-11-12-29-20/h1-5,8,13H,6-7,9-12,14H2,(H,22,25)