N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)carbonyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorophenyl)carbonyl-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-[(4-chlorophenyl)-oxomethyl]-4-(3-methoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: 1-(4-chlorobenzoyl)-4-(3-methoxyphenyl)-N-piperonyl-pyrrolidine-3-carboxamide Formula: C27H25ClN2O5 MolecularWeight: 492.9508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H25ClN2O5/c1-33-21-4-2-3-19(12-21)22-14-30(27(32)18-6-8-20(28)9-7-18)15-23(22)26(31)29-13-17-5-10-24-25(11-17)35-16-34-24/h2-12,22-23H,13-16H2,1H3,(H,29,31)