N-(1-adamantyl)-3,4-bis(chloranyl)-5-nitro-benzamide

Systemtic Name: N-(1-adamantyl)-3,4-bis(chloranyl)-5-nitro-benzamide Openeye Name: N-(1-adamantyl)-3,4-dichloro-5-nitro-benzamide CAS Name: N-(1-adamantyl)-3,4-dichloro-5-nitrobenzamide IUPAC Name: N-(1-adamantyl)-3,4-dichloro-5-nitrobenzamide Traditional Name: N-(1-adamantyl)-3,4-dichloro-5-nitro-benzamide Formula: C17H18Cl2N2O3 MolecularWeight: 369.24242

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC(=C(C(=C4)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)C4=CC(=C(C(=C4)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H18Cl2N2O3/c18-13-4-12(5-14(15(13)19)21(23)24)16(22)20-17-6-9-1-10(7-17)3-11(2-9)8-17/h4-5,9-11H,1-3,6-8H2,(H,20,22)