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

Systemtic Name: 4-[(1R,3S)-1-(aminomethyl)-6-methyl-5-oxidanyl-3,4-dihydro-1H-isochromen-3-yl]-N-methyl-N-phenyl-piperidine-1-carboxamide Openeye Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-isochroman-3-yl]-N-methyl-N-phenyl-piperidine-1-carboxamide CAS Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-3,4-dihydro-1H-2-benzopyran-3-yl]-N-methyl-N-phenyl-1-piperidinecarboxamide IUPAC Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-3,4-dihydro-1H-isochromen-3-yl]-N-methyl-N-phenylpiperidine-1-carboxamide Traditional Name: 4-[(1R,3S)-1-(aminomethyl)-5-hydroxy-6-methyl-isochroman-3-yl]-N-methyl-N-phenyl-piperidine-1-carboxamide Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O3/c1-16-8-9-19-20(23(16)28)14-21(30-22(19)15-25)17-10-12-27(13-11-17)24(29)26(2)18-6-4-3-5-7-18/h3-9,17,21-22,28H,10-15,25H2,1-2H3/t21-,22-/m0/s1