1,1-dimethyl-2-(phenylmethyl)-3-[3-(1-phenylpropan-2-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine

Systemtic Name: 1,1-dimethyl-2-(phenylmethyl)-3-[3-(1-phenylpropan-2-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine Openeye Name: 2-benzyl-1,1-dimethyl-3-[3-(1-methyl-2-phenyl-ethyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine CAS Name: 1,1-dimethyl-2-(phenylmethyl)-3-[3-(1-phenylpropan-2-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine IUPAC Name: 2-benzyl-1,1-dimethyl-3-[3-(1-phenylpropan-2-yl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine Traditional Name: 2-benzyl-1,1-dimethyl-3-[3-(1-methyl-2-phenyl-ethyl)-1-oxa-3-azonia-2-azanidacyclopent-3-en-5-ylidene]guanidine Formula: C21H25N5O MolecularWeight: 363.4561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)[N+]2=CC(=NC(=NCC3=CC=CC=C3)N(C)C)O[N-]2

Isomeric SMILES

CC(CC1=CC=CC=C1)[N+]2=CC(=NC(=NCC3=CC=CC=C3)N(C)C)O[N-]2

InChI

InChI=1S/C21H25N5O/c1-17(14-18-10-6-4-7-11-18)26-16-20(27-24-26)23-21(25(2)3)22-15-19-12-8-5-9-13-19/h4-13,16-17H,14-15H2,1-3H3