2-[(3,4-dichlorophenyl)carbamoyl-(1-pyridin-4-ylethyl)amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3,4-dichlorophenyl)carbamoyl-(1-pyridin-4-ylethyl)amino]ethyl-dimethyl-azanium Openeye Name: 2-[(3,4-dichlorophenyl)carbamoyl-[1-(4-pyridyl)ethyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3,4-dichloroanilino)-oxomethyl]-(1-pyridin-4-ylethyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[(3,4-dichlorophenyl)carbamoyl-(1-pyridin-4-ylethyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(3,4-dichlorophenyl)carbamoyl-[1-(4-pyridyl)ethyl]amino]ethyl-dimethyl-ammonium Formula: C18H23Cl2N4O+ MolecularWeight: 382.30742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)N(CC[NH+](C)C)C(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C1=CC=NC=C1)N(CC[NH+](C)C)C(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C18H22Cl2N4O/c1-13(14-6-8-21-9-7-14)24(11-10-23(2)3)18(25)22-15-4-5-16(19)17(20)12-15/h4-9,12-13H,10-11H2,1-3H3,(H,22,25)/p+1