ethyl 1-aminocarbonyl-4-chloranyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-aminocarbonyl-4-chloranyl-2-[(3-chloranyl-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-carbamoyl-4-chloro-2-[(3-chloro-4-methoxy-phenyl)methylcarbamoyl]-1-phenyl-piperidin-1-ium-4-carboxylate CAS Name: 1-carbamoyl-4-chloro-2-[[(3-chloro-4-methoxyphenyl)methylamino]-oxomethyl]-1-phenyl-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-carbamoyl-4-chloro-2-[(3-chloro-4-methoxyphenyl)methylcarbamoyl]-1-phenylpiperidin-1-ium-4-carboxylate Traditional Name: 1-carbamoyl-4-chloro-2-[(3-chloro-4-methoxy-benzyl)carbamoyl]-1-phenyl-piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C24H28Cl2N3O5+ MolecularWeight: 509.40222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[N+](C(C1)C(=O)NCC2=CC(=C(C=C2)OC)Cl)(C3=CC=CC=C3)C(=O)N)Cl

Isomeric SMILES

CCOC(=O)C1(CC[N+](C(C1)C(=O)NCC2=CC(=C(C=C2)OC)Cl)(C3=CC=CC=C3)C(=O)N)Cl

InChI

InChI=1S/C24H27Cl2N3O5/c1-3-34-22(31)24(26)11-12-29(23(27)32,17-7-5-4-6-8-17)19(14-24)21(30)28-15-16-9-10-20(33-2)18(25)13-16/h4-10,13,19H,3,11-12,14-15H2,1-2H3,(H2-,27,28,30,32)/p+1