(3S)-2-[(2S)-5-methyl-2-phenylmethoxy-hex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde

Systemtic Name: (3S)-2-[(2S)-5-methyl-2-phenylmethoxy-hex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Openeye Name: (3S)-2-[(2S)-2-benzyloxy-5-methyl-hex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde CAS Name: (3S)-2-[(2S)-5-methyl-2-phenylmethoxyhex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carboxaldehyde IUPAC Name: (3S)-2-[(2S)-5-methyl-2-phenylmethoxyhex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Traditional Name: (3S)-2-[(2S)-2-benzoxy-5-methyl-hex-4-enyl]-3,4-dihydro-1H-isoquinoline-3-carbaldehyde Formula: C24H29NO2 MolecularWeight: 363.49256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(CN1CC2=CC=CC=C2CC1C=O)OCC3=CC=CC=C3)C

Isomeric SMILES

CC(=CC[C@@H](CN1CC2=CC=CC=C2C[C@H]1C=O)OCC3=CC=CC=C3)C

InChI

InChI=1S/C24H29NO2/c1-19(2)12-13-24(27-18-20-8-4-3-5-9-20)16-25-15-22-11-7-6-10-21(22)14-23(25)17-26/h3-12,17,23-24H,13-16,18H2,1-2H3/t23-,24-/m0/s1