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

Systemtic Name: N-butyl-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-benzamide Openeye Name: N-butyl-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-benzamide CAS Name: N-butyl-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide IUPAC Name: N-butyl-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitrobenzamide Traditional Name: N-butyl-4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-nitro-benzamide Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=C(C=C1)N2CCC3(CC2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC(=C(C=C1)N2CCC3(CC2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O5/c1-2-3-8-19-17(22)14-4-5-15(16(13-14)21(23)24)20-9-6-18(7-10-20)25-11-12-26-18/h4-5,13H,2-3,6-12H2,1H3,(H,19,22)