(phenylmethyl) N-[6-azanyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-hexan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[6-azanyl-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxidanylidene-hexan-2-yl]carbamate Openeye Name: benzyl N-[5-amino-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)pentyl]carbamate CAS Name: N-[6-amino-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxohexan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[6-amino-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-oxohexan-2-yl]carbamate Traditional Name: N-[5-amino-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)pentyl]carbamic acid benzyl ester Formula: C25H33N3O5 MolecularWeight: 455.54662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C(CCCCN)NC(=O)OCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C(CCCCN)NC(=O)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C25H33N3O5/c1-31-22-14-19-11-13-28(16-20(19)15-23(22)32-2)24(29)21(10-6-7-12-26)27-25(30)33-17-18-8-4-3-5-9-18/h3-5,8-9,14-15,21H,6-7,10-13,16-17,26H2,1-2H3,(H,27,30)