(2S)-2-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]acetyl]amino]-N-ethyl-propionamide Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CC1C2=CC=CC=C2C=CN1C(=O)C

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)C[C@H]1C2=CC=CC=C2C=CN1C(=O)C

InChI

InChI=1S/C18H23N3O3/c1-4-19-18(24)12(2)20-17(23)11-16-15-8-6-5-7-14(15)9-10-21(16)13(3)22/h5-10,12,16H,4,11H2,1-3H3,(H,19,24)(H,20,23)/t12-,16-/m0/s1