4-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-(azepan-1-yl)-N-(2-furylmethyl)-3-nitro-N-(3-pyridylmethyl)benzamide CAS Name: 4-(1-azepanyl)-N-(2-furanylmethyl)-3-nitro-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-(azepan-1-yl)-N-(furan-2-ylmethyl)-3-nitro-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-(azepan-1-yl)-N-(2-furfuryl)-3-nitro-N-(3-pyridylmethyl)benzamide Formula: C24H26N4O4 MolecularWeight: 434.48764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N(CC3=CN=CC=C3)CC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N(CC3=CN=CC=C3)CC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O4/c29-24(27(18-21-8-6-14-32-21)17-19-7-5-11-25-16-19)20-9-10-22(23(15-20)28(30)31)26-12-3-1-2-4-13-26/h5-11,14-16H,1-4,12-13,17-18H2