(phenylmethyl) 3-[[2-(3-ethoxy-3-oxidanylidene-propyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-piperidin-4-yloxy-amino]-3-oxidanylidene-propanoate

Systemtic Name: (phenylmethyl) 3-[[2-(3-ethoxy-3-oxidanylidene-propyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-piperidin-4-yloxy-amino]-3-oxidanylidene-propanoate Openeye Name: benzyl 3-[[2-(3-ethoxy-3-oxo-propyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-(4-piperidyloxy)amino]-3-oxo-propanoate CAS Name: 3-[[2-(3-ethoxy-3-oxopropyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-(4-piperidinyloxy)amino]-3-oxopropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[2-(3-ethoxy-3-oxopropyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-piperidin-4-yloxyamino]-3-oxopropanoate Traditional Name: 3-[[2-(3-ethoxy-3-keto-propyl)-1-methyl-3,4-dihydroisoquinolin-1-yl]-(4-piperidyloxy)amino]-3-keto-propionic acid benzyl ester Formula: C30H39N3O6 MolecularWeight: 537.64716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCC2=CC=CC=C2C1(C)N(C(=O)CC(=O)OCC3=CC=CC=C3)OC4CCNCC4

Isomeric SMILES

CCOC(=O)CCN1CCC2=CC=CC=C2C1(C)N(C(=O)CC(=O)OCC3=CC=CC=C3)OC4CCNCC4

InChI

InChI=1S/C30H39N3O6/c1-3-37-28(35)16-20-32-19-15-24-11-7-8-12-26(24)30(32,2)33(39-25-13-17-31-18-14-25)27(34)21-29(36)38-22-23-9-5-4-6-10-23/h4-12,25,31H,3,13-22H2,1-2H3