(2S)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-N-propyl-propanamide

Systemtic Name: (2S)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethanoylamino]-N-propyl-propanamide Openeye Name: (2S)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N-propyl-propanamide CAS Name: (2S)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1-oxoethyl]amino]-N-propylpropanamide IUPAC Name: (2S)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N-propylpropanamide Traditional Name: (2S)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)acetyl]amino]-N-propyl-propionamide Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)NC(=O)CN1CCC2=CC=CC=C2C1

Isomeric SMILES

CCCNC(=O)[C@H](C)NC(=O)CN1CCC2=CC=CC=C2C1

InChI

InChI=1S/C17H25N3O2/c1-3-9-18-17(22)13(2)19-16(21)12-20-10-8-14-6-4-5-7-15(14)11-20/h4-7,13H,3,8-12H2,1-2H3,(H,18,22)(H,19,21)/t13-/m0/s1