5-methoxy-4-(2-methoxyethoxy)-2-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 5-methoxy-4-(2-methoxyethoxy)-2-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 5-methoxy-4-(2-methoxyethoxy)-2-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 5-methoxy-4-(2-methoxyethoxy)-2-nitro-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 5-methoxy-4-(2-methoxyethoxy)-2-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-5-methoxy-4-(2-methoxyethoxy)-2-nitro-benzamide Formula: C20H29N3O7 MolecularWeight: 423.46016

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCCCN2CCCCCC2=O)OC

Isomeric SMILES

COCCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NCCCN2CCCCCC2=O)OC

InChI

InChI=1S/C20H29N3O7/c1-28-11-12-30-18-14-16(23(26)27)15(13-17(18)29-2)20(25)21-8-6-10-22-9-5-3-4-7-19(22)24/h13-14H,3-12H2,1-2H3,(H,21,25)