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4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide

4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide

Systemtic Name:4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide
Openeye Name:4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide
CAS Name:4-(1-azepanyl)-3-nitro-N-(4-phenylphenyl)benzamide
IUPAC Name:4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide
Traditional Name:4-(azepan-1-yl)-3-nitro-N-(4-phenylphenyl)benzamide
Formula: C25H25N3O3
MolecularWeight: 415.4843
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4)[N+](=O)[O-]


Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4)[N+](=O)[O-]


InChI

InChI=1S/C25H25N3O3/c29-25(26-22-13-10-20(11-14-22)19-8-4-3-5-9-19)21-12-15-23(24(18-21)28(30)31)27-16-6-1-2-7-17-27/h3-5,8-15,18H,1-2,6-7,16-17H2,(H,26,29)


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