propan-2-yl 3-[7-(2-piperidin-4-yloxyethanoylamino)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate

Systemtic Name: propan-2-yl 3-[7-(2-piperidin-4-yloxyethanoylamino)-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Openeye Name: isopropyl 3-[7-[[2-(4-piperidyloxy)acetyl]amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate CAS Name: 3-[7-[[1-oxo-2-(4-piperidinyloxy)ethyl]amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[7-[(2-piperidin-4-yloxyacetyl)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Traditional Name: 3-[7-[[2-(4-piperidyloxy)acetyl]amino]-3,4-dihydro-1H-isoquinolin-2-yl]propionic acid isopropyl ester Formula: C22H33N3O4 MolecularWeight: 403.51512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCN1CCC2=C(C1)C=C(C=C2)NC(=O)COC3CCNCC3

Isomeric SMILES

CC(C)OC(=O)CCN1CCC2=C(C1)C=C(C=C2)NC(=O)COC3CCNCC3

InChI

InChI=1S/C22H33N3O4/c1-16(2)29-22(27)8-12-25-11-7-17-3-4-19(13-18(17)14-25)24-21(26)15-28-20-5-9-23-10-6-20/h3-4,13,16,20,23H,5-12,14-15H2,1-2H3,(H,24,26)