1-[(6-iodanyl-3,4-dihydro-2H-chromen-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]propan-2-ol

Systemtic Name: 1-[(6-iodanyl-3,4-dihydro-2H-chromen-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]propan-2-ol Openeye Name: 1-[(6-iodochroman-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]propan-2-ol CAS Name: 1-[(6-iodo-3,4-dihydro-2H-1-benzopyran-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]-2-propanol IUPAC Name: 1-[(6-iodo-3,4-dihydro-2H-chromen-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]propan-2-ol Traditional Name: 1-[(6-iodochroman-2-yl)methylamino]-3-[(2-isocyano-1H-indol-4-yl)oxy]propan-2-ol Formula: C22H22IN3O3 MolecularWeight: 503.33285

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC2=C(N1)C=CC=C2OCC(CNCC3CCC4=C(O3)C=CC(=C4)I)O

Isomeric SMILES

[C-]#[N+]C1=CC2=C(N1)C=CC=C2OCC(CNCC3CCC4=C(O3)C=CC(=C4)I)O

InChI

InChI=1S/C22H22IN3O3/c1-24-22-10-18-19(26-22)3-2-4-21(18)28-13-16(27)11-25-12-17-7-5-14-9-15(23)6-8-20(14)29-17/h2-4,6,8-10,16-17,25-27H,5,7,11-13H2