bis[2-[(4-chlorophenyl)carbamoyloxy]ethyl]-ethyl-(phenylmethyl)azanium

Systemtic Name: bis[2-[(4-chlorophenyl)carbamoyloxy]ethyl]-ethyl-(phenylmethyl)azanium Openeye Name: benzyl-bis[2-[(4-chlorophenyl)carbamoyloxy]ethyl]-ethyl-ammonium CAS Name: bis[2-[(4-chloroanilino)-oxomethoxy]ethyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-bis[2-[(4-chlorophenyl)carbamoyloxy]ethyl]-ethylazanium Traditional Name: benzyl-bis[2-[(4-chlorophenyl)carbamoyloxy]ethyl]-ethyl-ammonium Formula: C27H30Cl2N3O4+ MolecularWeight: 531.4508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CCOC(=O)NC1=CC=C(C=C1)Cl)(CCOC(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC[N+](CCOC(=O)NC1=CC=C(C=C1)Cl)(CCOC(=O)NC2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C27H29Cl2N3O4/c1-2-32(20-21-6-4-3-5-7-21,16-18-35-26(33)30-24-12-8-22(28)9-13-24)17-19-36-27(34)31-25-14-10-23(29)11-15-25/h3-15H,2,16-20H2,1H3,(H-,30,31,33,34)/p+1