1-[(3-bromophenyl)methyl]-N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[(3-bromophenyl)methyl]-N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)piperidine-4-carboxamide Openeye Name: 1-[(3-bromophenyl)methyl]-N-(7-methoxy-2,2-dimethyl-chroman-4-yl)piperidine-4-carboxamide CAS Name: 1-[(3-bromophenyl)methyl]-N-(7-methoxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-4-piperidinecarboxamide IUPAC Name: 1-[(3-bromophenyl)methyl]-N-(7-methoxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)piperidine-4-carboxamide Traditional Name: 1-(3-bromobenzyl)-N-(7-methoxy-2,2-dimethyl-chroman-4-yl)isonipecotamide Formula: C25H31BrN2O3 MolecularWeight: 487.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(O1)C=C(C=C2)OC)NC(=O)C3CCN(CC3)CC4=CC(=CC=C4)Br)C

Isomeric SMILES

CC1(CC(C2=C(O1)C=C(C=C2)OC)NC(=O)C3CCN(CC3)CC4=CC(=CC=C4)Br)C

InChI

InChI=1S/C25H31BrN2O3/c1-25(2)15-22(21-8-7-20(30-3)14-23(21)31-25)27-24(29)18-9-11-28(12-10-18)16-17-5-4-6-19(26)13-17/h4-8,13-14,18,22H,9-12,15-16H2,1-3H3,(H,27,29)