[[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino] 4-chloranylbenzoate

Systemtic Name: [[1-(phenylmethyl)piperidin-1-ium-4-ylidene]amino] 4-chloranylbenzoate Openeye Name: [(1-benzylpiperidin-1-ium-4-ylidene)amino] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [[1-(phenylmethyl)-4-piperidin-1-iumylidene]amino] ester IUPAC Name: [(1-benzylpiperidin-1-ium-4-ylidene)amino] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(1-benzylpiperidin-1-ium-4-ylidene)amino] ester Formula: C19H20ClN2O2+ MolecularWeight: 343.8273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1=NOC(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1=NOC(=O)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C19H19ClN2O2/c20-17-8-6-16(7-9-17)19(23)24-21-18-10-12-22(13-11-18)14-15-4-2-1-3-5-15/h1-9H,10-14H2/p+1