N-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-(4-methyl-3-nitroanilino)-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-(4-methyl-3-nitro-anilino)ethyl]adamantane-1-carboxamide Formula: C20H25N3O4 MolecularWeight: 371.4302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4/c1-12-2-3-16(7-17(12)23(26)27)22-18(24)11-21-19(25)20-8-13-4-14(9-20)6-15(5-13)10-20/h2-3,7,13-15H,4-6,8-11H2,1H3,(H,21,25)(H,22,24)