N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitro-benzamide

Systemtic Name: N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitro-benzamide Openeye Name: N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitro-benzamide CAS Name: N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitrobenzamide IUPAC Name: N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitrobenzamide Traditional Name: N-[1-(1-adamantyl)ethyl]-4-(dimethylamino)-2-methoxy-5-nitro-benzamide Formula: C22H31N3O4 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4OC)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=C(C=C4OC)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H31N3O4/c1-13(22-10-14-5-15(11-22)7-16(6-14)12-22)23-21(26)17-8-19(25(27)28)18(24(2)3)9-20(17)29-4/h8-9,13-16H,5-7,10-12H2,1-4H3,(H,23,26)