2-[3-[(2S)-1-(butylamino)propan-2-yl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methyl-propanamide

Systemtic Name: 2-[3-[(2S)-1-(butylamino)propan-2-yl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methyl-propanamide Openeye Name: 2-[3-[(1S)-2-(butylamino)-1-methyl-ethyl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methyl-propanamide CAS Name: 2-[3-[(2S)-1-(butylamino)propan-2-yl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide IUPAC Name: 2-[3-[(2S)-1-(butylamino)propan-2-yl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methylpropanamide Traditional Name: 2-[3-[(1S)-2-(butylamino)-1-methyl-ethyl]-2-(3,5-dimethylphenyl)-3a,7a-dihydro-1H-indol-5-yl]-N,N-diethyl-2-methyl-propionamide Formula: C31H47N3O MolecularWeight: 477.72438

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(C)C1=C(NC2C1C=C(C=C2)C(C)(C)C(=O)N(CC)CC)C3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCNC[C@@H](C)C1=C(NC2C1C=C(C=C2)C(C)(C)C(=O)N(CC)CC)C3=CC(=CC(=C3)C)C

InChI

InChI=1S/C31H47N3O/c1-9-12-15-32-20-23(6)28-26-19-25(31(7,8)30(35)34(10-2)11-3)13-14-27(26)33-29(28)24-17-21(4)16-22(5)18-24/h13-14,16-19,23,26-27,32-33H,9-12,15,20H2,1-8H3/t23-,26?,27?/m1/s1