2-ethoxy-7-isocyano-4a-(phenylmethyl)-4,9-dihydro-3H-phenanthrene

Systemtic Name: 2-ethoxy-7-isocyano-4a-(phenylmethyl)-4,9-dihydro-3H-phenanthrene Openeye Name: 4a-benzyl-2-ethoxy-7-isocyano-4,9-dihydro-3H-phenanthrene CAS Name: 2-ethoxy-7-isocyano-4a-(phenylmethyl)-4,9-dihydro-3H-phenanthrene IUPAC Name: 4a-benzyl-2-ethoxy-7-isocyano-4,9-dihydro-3H-phenanthrene Traditional Name: 4a-benzyl-2-ethoxy-7-isocyano-4,9-dihydro-3H-phenanthrene Formula: C24H23NO MolecularWeight: 341.44552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CCC3=C(C2(CC1)CC4=CC=CC=C4)C=CC(=C3)[N+]#[C-]

Isomeric SMILES

CCOC1=CC2=CCC3=C(C2(CC1)CC4=CC=CC=C4)C=CC(=C3)[N+]#[C-]

InChI

InChI=1S/C24H23NO/c1-3-26-22-13-14-24(17-18-7-5-4-6-8-18)20(16-22)10-9-19-15-21(25-2)11-12-23(19)24/h4-8,10-12,15-16H,3,9,13-14,17H2,1H3