3-(4-methylphenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]adamantane-1-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]adamantane-1-carboxamide Openeye Name: N-[(E)-(4-nitrophenyl)methyleneamino]-3-(p-tolyl)adamantane-1-carboxamide CAS Name: 3-(4-methylphenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]-1-adamantanecarboxamide IUPAC Name: 3-(4-methylphenyl)-N-[(E)-(4-nitrophenyl)methylideneamino]adamantane-1-carboxamide Traditional Name: N-[(E)-(4-nitrobenzylidene)amino]-3-(p-tolyl)adamantane-1-carboxamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NN=CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)N/N=C/C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O3/c1-17-2-6-21(7-3-17)24-11-19-10-20(12-24)14-25(13-19,16-24)23(29)27-26-15-18-4-8-22(9-5-18)28(30)31/h2-9,15,19-20H,10-14,16H2,1H3,(H,27,29)/b26-15+