4-[(1R,3S)-1-(aminomethyl)-6-methyl-5-oxidanyl-3,4-dihydro-1H-isochromen-3-yl]-N,N-diphenyl-piperidine-1-carboxamide

Systemtic Name: 4-[(1R,3S)-1-(aminomethyl)-6-methyl-5-oxidanyl-3,4-dihydro-1H-isochromen-3-yl]-N,N-diphenyl-piperidine-1-carboxamide Openeye Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-isochroman-3-yl]-N,N-diphenyl-piperidine-1-carboxamide CAS Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-3,4-dihydro-1H-2-benzopyran-3-yl]-N,N-diphenyl-1-piperidinecarboxamide IUPAC Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-3,4-dihydro-1H-isochromen-3-yl]-N,N-diphenylpiperidine-1-carboxamide Traditional Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-isochroman-3-yl]-N,N-diphenyl-piperidine-1-carboxamide Formula: C29H33N3O3 MolecularWeight: 471.59062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(OC(C2)C3CCN(CC3)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5)CN)O

Isomeric SMILES

CC1=C(C2=C(C=C1)[C@@H](O[C@@H](C2)C3CCN(CC3)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5)CN)O

InChI

InChI=1S/C29H33N3O3/c1-20-12-13-24-25(28(20)33)18-26(35-27(24)19-30)21-14-16-31(17-15-21)29(34)32(22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-13,21,26-27,33H,14-19,30H2,1H3/t26-,27-/m0/s1