2-iodanyl-N-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]aniline

Systemtic Name: 2-iodanyl-N-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]aniline Openeye Name: 2-iodo-N-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]aniline CAS Name: 2-iodo-N-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]aniline IUPAC Name: 2-iodo-N-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]aniline Traditional Name: (2-iodophenyl)-[[(1S,2S)-7-methoxy-2-methyl-1-propyl-3,4,9,10-tetrahydro-1H-phenanthren-2-yl]methyl]amine Formula: C26H32INO MolecularWeight: 501.44285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C2=C(CCC1(C)CNC3=CC=CC=C3I)C4=C(CC2)C=C(C=C4)OC

Isomeric SMILES

CCC[C@H]1C2=C(CC[C@]1(C)CNC3=CC=CC=C3I)C4=C(CC2)C=C(C=C4)OC

InChI

InChI=1S/C26H32INO/c1-4-7-23-22-12-10-18-16-19(29-3)11-13-20(18)21(22)14-15-26(23,2)17-28-25-9-6-5-8-24(25)27/h5-6,8-9,11,13,16,23,28H,4,7,10,12,14-15,17H2,1-3H3/t23-,26+/m0/s1