butyl 2-[[4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]carbamoyl]-2-ethyl-azetidine-1-carboxylate

Systemtic Name: butyl 2-[[4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]carbamoyl]-2-ethyl-azetidine-1-carboxylate Openeye Name: butyl 2-[[3-(4-chlorophenyl)-2-(3-cyanophenyl)-1-methyl-propyl]carbamoyl]-2-ethyl-azetidine-1-carboxylate CAS Name: 2-[[[4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]amino]-oxomethyl]-2-ethyl-1-azetidinecarboxylic acid butyl ester IUPAC Name: butyl 2-[[4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]carbamoyl]-2-ethylazetidine-1-carboxylate Traditional Name: 2-[[3-(4-chlorophenyl)-2-(3-cyanophenyl)-1-methyl-propyl]carbamoyl]-2-ethyl-azetidine-1-carboxylic acid butyl ester Formula: C28H34ClN3O3 MolecularWeight: 496.04086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC1(CC)C(=O)NC(C)C(CC2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCCCOC(=O)N1CCC1(CC)C(=O)NC(C)C(CC2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C28H34ClN3O3/c1-4-6-16-35-27(34)32-15-14-28(32,5-2)26(33)31-20(3)25(18-21-10-12-24(29)13-11-21)23-9-7-8-22(17-23)19-30/h7-13,17,20,25H,4-6,14-16,18H2,1-3H3,(H,31,33)