N-[4-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[[(Z)-(3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[[(Z)-(3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[[(Z)-(3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[[(Z)-(3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[[(Z)-(6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]adamantane-1-carboxamide Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)NC=C5C=C(C=CC5=O)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)N/C=C\5/C=C(C=CC5=O)[N+](=O)[O-]

InChI

InChI=1S/C24H25N3O4/c28-22-6-5-21(27(30)31)10-18(22)14-25-19-1-3-20(4-2-19)26-23(29)24-11-15-7-16(12-24)9-17(8-15)13-24/h1-6,10,14-17,25H,7-9,11-13H2,(H,26,29)/b18-14-