N-(3-bromophenyl)-N-[[(3R,4S)-8-methoxy-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromen-7-yl]methyl]benzamide

Systemtic Name: N-(3-bromophenyl)-N-[[(3R,4S)-8-methoxy-2,2-dimethyl-3-oxidanyl-4-piperidin-1-yl-3,4-dihydrochromen-7-yl]methyl]benzamide Openeye Name: N-(3-bromophenyl)-N-[[(3R,4S)-3-hydroxy-8-methoxy-2,2-dimethyl-4-(1-piperidyl)chroman-7-yl]methyl]benzamide CAS Name: N-(3-bromophenyl)-N-[[(3R,4S)-3-hydroxy-8-methoxy-2,2-dimethyl-4-(1-piperidinyl)-3,4-dihydro-2H-1-benzopyran-7-yl]methyl]benzamide IUPAC Name: N-(3-bromophenyl)-N-[[(3R,4S)-3-hydroxy-8-methoxy-2,2-dimethyl-4-piperidin-1-yl-3,4-dihydrochromen-7-yl]methyl]benzamide Traditional Name: N-(3-bromophenyl)-N-[[(3R,4S)-3-hydroxy-8-methoxy-2,2-dimethyl-4-piperidino-chroman-7-yl]methyl]benzamide Formula: C31H35BrN2O4 MolecularWeight: 579.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C(=C(C=C2)CN(C3=CC(=CC=C3)Br)C(=O)C4=CC=CC=C4)OC)N5CCCCC5)O)C

Isomeric SMILES

CC1([C@@H]([C@H](C2=C(O1)C(=C(C=C2)CN(C3=CC(=CC=C3)Br)C(=O)C4=CC=CC=C4)OC)N5CCCCC5)O)C

InChI

InChI=1S/C31H35BrN2O4/c1-31(2)29(35)26(33-17-8-5-9-18-33)25-16-15-22(27(37-3)28(25)38-31)20-34(24-14-10-13-23(32)19-24)30(36)21-11-6-4-7-12-21/h4,6-7,10-16,19,26,29,35H,5,8-9,17-18,20H2,1-3H3/t26-,29+/m0/s1