phenyl (1Z)-N-isocyano-4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidine-1-carboximidate

Systemtic Name: phenyl (1Z)-N-isocyano-4-[[(2-methoxyphenyl)carbonylamino]methyl]-4-phenyl-piperidine-1-carboximidate Openeye Name: phenyl (1Z)-N-isocyano-4-[[(2-methoxybenzoyl)amino]methyl]-4-phenyl-piperidine-1-carboximidate CAS Name: (1Z)-N-isocyano-4-[[[(2-methoxyphenyl)-oxomethyl]amino]methyl]-4-phenyl-1-piperidinecarboximidic acid phenyl ester IUPAC Name: phenyl (1Z)-N-isocyano-4-[[(2-methoxybenzoyl)amino]methyl]-4-phenylpiperidine-1-carboximidate Traditional Name: (1Z)-N-isocyano-4-[(o-anisoylamino)methyl]-4-phenyl-piperidine-1-carboximidic acid phenyl ester Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(=N[N+]#[C-])OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)/C(=N/[N+]#[C-])/OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O3/c1-29-31-27(35-23-13-7-4-8-14-23)32-19-17-28(18-20-32,22-11-5-3-6-12-22)21-30-26(33)24-15-9-10-16-25(24)34-2/h3-16H,17-21H2,2H3,(H,30,33)/b31-27-