N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzamide Openeye Name: N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzamide CAS Name: N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitrobenzamide Traditional Name: N-[(E)-1-(1-adamantyl)ethylideneamino]-4-methyl-3-nitro-benzamide Formula: C20H25N3O3 MolecularWeight: 355.4308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NN=C(C)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/N=C(\C)/C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O3/c1-12-3-4-17(8-18(12)23(25)26)19(24)22-21-13(2)20-9-14-5-15(10-20)7-16(6-14)11-20/h3-4,8,14-16H,5-7,9-11H2,1-2H3,(H,22,24)/b21-13+