carbamimidoyl-cyano-(6-cyano-3,3-dimethyl-1,2-dihydroinden-1-yl)-phenyl-azanium

Systemtic Name: carbamimidoyl-cyano-(6-cyano-3,3-dimethyl-1,2-dihydroinden-1-yl)-phenyl-azanium Openeye Name: carbamimidoyl-cyano-(6-cyano-3,3-dimethyl-indan-1-yl)-phenyl-ammonium CAS Name: carbamimidoyl-cyano-(6-cyano-3,3-dimethyl-1,2-dihydroinden-1-yl)-phenylammonium IUPAC Name: carbamimidoyl-cyano-(6-cyano-3,3-dimethyl-1,2-dihydroinden-1-yl)-phenylazanium Traditional Name: amidino-cyano-(6-cyano-3,3-dimethyl-indan-1-yl)-phenyl-ammonium Formula: C20H20N5+ MolecularWeight: 330.4063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C1C=CC(=C2)C#N)[N+](C#N)(C3=CC=CC=C3)C(=N)N)C

Isomeric SMILES

CC1(CC(C2=C1C=CC(=C2)C#N)[N+](C#N)(C3=CC=CC=C3)C(=N)N)C

InChI

InChI=1S/C20H20N5/c1-20(2)11-18(16-10-14(12-21)8-9-17(16)20)25(13-22,19(23)24)15-6-4-3-5-7-15/h3-10,18H,11H2,1-2H3,(H3,23,24)/q+1