N-[2-(cyclohexylamino)-5-isocyano-phenyl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[2-(cyclohexylamino)-5-isocyano-phenyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[2-(cyclohexylamino)-5-isocyano-phenyl]benzamide CAS Name: N-[2-(cyclohexylamino)-5-isocyanophenyl]-4-phenylmethoxybenzamide IUPAC Name: N-[2-(cyclohexylamino)-5-isocyanophenyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[2-(cyclohexylamino)-5-isocyano-phenyl]benzamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC(=C(C=C1)NC2CCCCC2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

[C-]#[N+]C1=CC(=C(C=C1)NC2CCCCC2)NC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2/c1-28-23-14-17-25(29-22-10-6-3-7-11-22)26(18-23)30-27(31)21-12-15-24(16-13-21)32-19-20-8-4-2-5-9-20/h2,4-5,8-9,12-18,22,29H,3,6-7,10-11,19H2,(H,30,31)