2-chloranyl-3-(2-piperidin-1-ium-1-ylethylimino)naphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-(2-piperidin-1-ium-1-ylethylimino)naphthalene-1,4-dione Openeye Name: 2-chloro-3-(2-piperidin-1-ium-1-ylethylimino)tetralin-1,4-dione CAS Name: 2-chloro-3-[2-(1-piperidin-1-iumyl)ethylimino]naphthalene-1,4-dione IUPAC Name: 2-chloro-3-(2-piperidin-1-ium-1-ylethylimino)naphthalene-1,4-dione Traditional Name: 2-chloro-3-(2-piperidin-1-ium-1-ylethylimino)tetralin-1,4-quinone Formula: C17H20ClN2O2+ MolecularWeight: 319.8059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN=C2C(C(=O)C3=CC=CC=C3C2=O)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCN=C2C(C(=O)C3=CC=CC=C3C2=O)Cl

InChI

InChI=1S/C17H19ClN2O2/c18-14-15(19-8-11-20-9-4-1-5-10-20)17(22)13-7-3-2-6-12(13)16(14)21/h2-3,6-7,14H,1,4-5,8-11H2/p+1