3-bromanyl-2,5,6-trimethoxy-N-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl]benzamide

Systemtic Name: 3-bromanyl-2,5,6-trimethoxy-N-[[1-(phenylmethyl)pyrrolidin-2-yl]methyl]benzamide Openeye Name: N-[(1-benzylpyrrolidin-2-yl)methyl]-3-bromo-2,5,6-trimethoxy-benzamide CAS Name: 3-bromo-2,5,6-trimethoxy-N-[[1-(phenylmethyl)-2-pyrrolidinyl]methyl]benzamide IUPAC Name: N-[(1-benzylpyrrolidin-2-yl)methyl]-3-bromo-2,5,6-trimethoxybenzamide Traditional Name: N-[(1-benzylpyrrolidin-2-yl)methyl]-3-bromo-2,5,6-trimethoxy-benzamide Formula: C22H27BrN2O4 MolecularWeight: 463.36478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1OC)C(=O)NCC2CCCN2CC3=CC=CC=C3)OC)Br

Isomeric SMILES

COC1=CC(=C(C(=C1OC)C(=O)NCC2CCCN2CC3=CC=CC=C3)OC)Br

InChI

InChI=1S/C22H27BrN2O4/c1-27-18-12-17(23)20(28-2)19(21(18)29-3)22(26)24-13-16-10-7-11-25(16)14-15-8-5-4-6-9-15/h4-6,8-9,12,16H,7,10-11,13-14H2,1-3H3,(H,24,26)