4-(azepan-1-yl)-N-[(1R)-1-(furan-2-yl)ethyl]-3-nitro-benzamide

Systemtic Name: 4-(azepan-1-yl)-N-[(1R)-1-(furan-2-yl)ethyl]-3-nitro-benzamide Openeye Name: 4-(azepan-1-yl)-N-[(1R)-1-(2-furyl)ethyl]-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-N-[(1R)-1-(2-furanyl)ethyl]-3-nitrobenzamide IUPAC Name: 4-(azepan-1-yl)-N-[(1R)-1-(furan-2-yl)ethyl]-3-nitrobenzamide Traditional Name: 4-(azepan-1-yl)-N-[(1R)-1-(2-furyl)ethyl]-3-nitro-benzamide Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC=CO1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O4/c1-14(18-7-6-12-26-18)20-19(23)15-8-9-16(17(13-15)22(24)25)21-10-4-2-3-5-11-21/h6-9,12-14H,2-5,10-11H2,1H3,(H,20,23)/t14-/m1/s1