(1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-5-ol

Systemtic Name: (1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-5-ol Openeye Name: (1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethyl-4-piperidyl)isochroman-5-ol CAS Name: (1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethyl-4-piperidinyl)-3,4-dihydro-1H-2-benzopyran-5-ol IUPAC Name: (1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethylpiperidin-4-yl)-3,4-dihydro-1H-isochromen-5-ol Traditional Name: (1R,3S)-1-(aminomethyl)-6-methyl-3-(1-phenethyl-4-piperidyl)isochroman-5-ol Formula: C24H32N2O2 MolecularWeight: 380.52308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(OC(C2)C3CCN(CC3)CCC4=CC=CC=C4)CN)O

Isomeric SMILES

CC1=C(C2=C(C=C1)[C@@H](O[C@@H](C2)C3CCN(CC3)CCC4=CC=CC=C4)CN)O

InChI

InChI=1S/C24H32N2O2/c1-17-7-8-20-21(24(17)27)15-22(28-23(20)16-25)19-10-13-26(14-11-19)12-9-18-5-3-2-4-6-18/h2-8,19,22-23,27H,9-16,25H2,1H3/t22-,23-/m0/s1