4-(azepan-1-yl)-3-nitro-N-(1-propan-2-ylpiperidin-4-yl)benzamide

Systemtic Name: 4-(azepan-1-yl)-3-nitro-N-(1-propan-2-ylpiperidin-4-yl)benzamide Openeye Name: 4-(azepan-1-yl)-N-(1-isopropyl-4-piperidyl)-3-nitro-benzamide CAS Name: 4-(1-azepanyl)-3-nitro-N-(1-propan-2-yl-4-piperidinyl)benzamide IUPAC Name: 4-(azepan-1-yl)-3-nitro-N-(1-propan-2-ylpiperidin-4-yl)benzamide Traditional Name: 4-(azepan-1-yl)-N-(1-isopropyl-4-piperidyl)-3-nitro-benzamide Formula: C21H32N4O3 MolecularWeight: 388.50378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H32N4O3/c1-16(2)23-13-9-18(10-14-23)22-21(26)17-7-8-19(20(15-17)25(27)28)24-11-5-3-4-6-12-24/h7-8,15-16,18H,3-6,9-14H2,1-2H3,(H,22,26)