N-(2,5-dimethylphenyl)-2-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(3S)-3-pyrrolidin-1-ylcarbonyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(3S)-3-[oxo(1-pyrrolidinyl)methyl]-3,4-dihydro-1H-isoquinolin-2-yl]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(3S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]acetamide Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CN2CC3=CC=CC=C3CC2C(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CN2CC3=CC=CC=C3C[C@H]2C(=O)N4CCCC4

InChI

InChI=1S/C24H29N3O2/c1-17-9-10-18(2)21(13-17)25-23(28)16-27-15-20-8-4-3-7-19(20)14-22(27)24(29)26-11-5-6-12-26/h3-4,7-10,13,22H,5-6,11-12,14-16H2,1-2H3,(H,25,28)/t22-/m0/s1