4-butyl-N-[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-N-pentyl-benzamide

Systemtic Name: 4-butyl-N-[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxidanylidene-ethyl]-N-pentyl-benzamide Openeye Name: 4-butyl-N-[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxo-ethyl]-N-pentyl-benzamide CAS Name: 4-butyl-N-[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-N-pentylbenzamide IUPAC Name: 4-butyl-N-[2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-2-oxoethyl]-N-pentylbenzamide Traditional Name: N-amyl-4-butyl-N-[2-keto-2-[(1S)-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]ethyl]benzamide Formula: C28H38N2O2 MolecularWeight: 434.61352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N1CCC2=CC=CC=C2C1C)C(=O)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCN(CC(=O)N1CCC2=CC=CC=C2[C@@H]1C)C(=O)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C28H38N2O2/c1-4-6-10-19-29(28(32)25-16-14-23(15-17-25)11-7-5-2)21-27(31)30-20-18-24-12-8-9-13-26(24)22(30)3/h8-9,12-17,22H,4-7,10-11,18-21H2,1-3H3/t22-/m0/s1