(phenylmethyl) 2-[7-[ethanoyl(piperidin-4-yloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate

Systemtic Name: (phenylmethyl) 2-[7-[ethanoyl(piperidin-4-yloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Openeye Name: benzyl 2-[7-[acetyl(4-piperidyloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate CAS Name: 2-[7-[acetyl(4-piperidinyloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[7-[acetyl(piperidin-4-yloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propanoate Traditional Name: 2-[7-[acetyl(4-piperidyloxy)amino]-3,4-dihydro-1H-isoquinolin-2-yl]propionic acid benzyl ester Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)N2CCC3=C(C2)C=C(C=C3)N(C(=O)C)OC4CCNCC4

Isomeric SMILES

CC(C(=O)OCC1=CC=CC=C1)N2CCC3=C(C2)C=C(C=C3)N(C(=O)C)OC4CCNCC4

InChI

InChI=1S/C26H33N3O4/c1-19(26(31)32-18-21-6-4-3-5-7-21)28-15-12-22-8-9-24(16-23(22)17-28)29(20(2)30)33-25-10-13-27-14-11-25/h3-9,16,19,25,27H,10-15,17-18H2,1-2H3