2-[3-isocyano-2-[5-(1-phenylmethoxypropan-2-yl)-1,2,3,4-tetrazol-1-yl]propoxy]pyridine

Systemtic Name: 2-[3-isocyano-2-[5-(1-phenylmethoxypropan-2-yl)-1,2,3,4-tetrazol-1-yl]propoxy]pyridine Openeye Name: 2-[2-[5-(2-benzyloxy-1-methyl-ethyl)tetrazol-1-yl]-3-isocyano-propoxy]pyridine CAS Name: 2-[3-isocyano-2-[5-(1-phenylmethoxypropan-2-yl)-1-tetrazolyl]propoxy]pyridine IUPAC Name: 2-[3-isocyano-2-[5-(1-phenylmethoxypropan-2-yl)tetrazol-1-yl]propoxy]pyridine Traditional Name: 2-[2-[5-(2-benzoxy-1-methyl-ethyl)tetrazol-1-yl]-3-isocyano-propoxy]pyridine Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1=CC=CC=C1)C2=NN=NN2C(C[N+]#[C-])COC3=CC=CC=N3

Isomeric SMILES

CC(COCC1=CC=CC=C1)C2=NN=NN2C(C[N+]#[C-])COC3=CC=CC=N3

InChI

InChI=1S/C20H22N6O2/c1-16(13-27-14-17-8-4-3-5-9-17)20-23-24-25-26(20)18(12-21-2)15-28-19-10-6-7-11-22-19/h3-11,16,18H,12-15H2,1H3