2-[(3-oxidanyl-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenyl-guanidine

Systemtic Name: 2-[(3-oxidanyl-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenyl-guanidine Openeye Name: 2-[(3-hydroxy-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenyl-guanidine CAS Name: 2-[(3-hydroxy-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenylguanidine IUPAC Name: 2-[(3-hydroxy-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenylguanidine Traditional Name: 2-[(3-hydroxy-2,4-dihydro-1,5-benzodioxepin-3-yl)methyl]-1-phenyl-guanidine Formula: C17H19N3O3 MolecularWeight: 313.35106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=CC=CC=C2O1)(CN=C(N)NC3=CC=CC=C3)O

Isomeric SMILES

C1C(COC2=CC=CC=C2O1)(CN=C(N)NC3=CC=CC=C3)O

InChI

InChI=1S/C17H19N3O3/c18-16(20-13-6-2-1-3-7-13)19-10-17(21)11-22-14-8-4-5-9-15(14)23-12-17/h1-9,21H,10-12H2,(H3,18,19,20)