(1S,3aS)-8-methoxy-1-methyl-N-(phenylmethyl)-2,3,3a,4,5,6-hexahydrophenalen-1-amine

Systemtic Name: (1S,3aS)-8-methoxy-1-methyl-N-(phenylmethyl)-2,3,3a,4,5,6-hexahydrophenalen-1-amine Openeye Name: (1S,3aS)-N-benzyl-8-methoxy-1-methyl-2,3,3a,4,5,6-hexahydrophenalen-1-amine CAS Name: (1S,3aS)-8-methoxy-1-methyl-N-(phenylmethyl)-2,3,3a,4,5,6-hexahydrophenalen-1-amine IUPAC Name: (1S,3aS)-N-benzyl-8-methoxy-1-methyl-2,3,3a,4,5,6-hexahydrophenalen-1-amine Traditional Name: [(1S,3aS)-8-methoxy-1-methyl-2,3,3a,4,5,6-hexahydrophenalen-1-yl]-benzyl-amine Formula: C22H27NO MolecularWeight: 321.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2CCCC3=CC(=CC1=C23)OC)NCC4=CC=CC=C4

Isomeric SMILES

C[C@@]1(CC[C@@H]2CCCC3=CC(=CC1=C23)OC)NCC4=CC=CC=C4

InChI

InChI=1S/C22H27NO/c1-22(23-15-16-7-4-3-5-8-16)12-11-17-9-6-10-18-13-19(24-2)14-20(22)21(17)18/h3-5,7-8,13-14,17,23H,6,9-12,15H2,1-2H3/t17-,22-/m0/s1