(1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-7a-methyl-3a-oxidanyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carbaldehyde

Systemtic Name: (1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-7a-methyl-3a-oxidanyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carbaldehyde Openeye Name: (1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-3a-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carbaldehyde CAS Name: (1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-3a-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carboxaldehyde IUPAC Name: (1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-3a-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carbaldehyde Traditional Name: (1S,3aS,5S,7aR)-5-[4-(2-dimethylaminoethyloxy)phenyl]-3a-hydroxy-7a-methyl-2,3,4,5,6,7-hexahydro-1H-indene-1-carbaldehyde Formula: C21H31NO3 MolecularWeight: 345.47574

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(CC1(CCC2C=O)O)C3=CC=C(C=C3)OCCN(C)C

Isomeric SMILES

C[C@]12CC[C@@H](C[C@]1(CC[C@@H]2C=O)O)C3=CC=C(C=C3)OCCN(C)C

InChI

InChI=1S/C21H31NO3/c1-20-10-8-17(14-21(20,24)11-9-18(20)15-23)16-4-6-19(7-5-16)25-13-12-22(2)3/h4-7,15,17-18,24H,8-14H2,1-3H3/t17-,18+,20+,21-/m0/s1