(1-ethoxy-1-oxidanylidene-hexan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: (1-ethoxy-1-oxidanylidene-hexan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: 1-ethoxycarbonylpentyl 6-benzyloxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[[2-[di(propan-2-yl)amino]ethylamino]-oxomethyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (1-ethoxy-1-oxohexan-2-yl) ester IUPAC Name: (1-ethoxy-1-oxohexan-2-yl) 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenylmethoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-benzoxy-1-[2-(diisopropylamino)ethylcarbamoyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid 1-carbethoxypentyl ester Formula: C34H49N3O6 MolecularWeight: 595.76936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OCC)OC(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCC(C(=O)OCC)OC(=O)N1CCC2=C(C1C(=O)NCCN(C(C)C)C(C)C)C=CC(=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C34H49N3O6/c1-7-9-15-30(33(39)41-8-2)43-34(40)37-20-18-27-22-28(42-23-26-13-11-10-12-14-26)16-17-29(27)31(37)32(38)35-19-21-36(24(3)4)25(5)6/h10-14,16-17,22,24-25,30-31H,7-9,15,18-21,23H2,1-6H3,(H,35,38)