2-hydroxyethyl 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: 2-hydroxyethyl 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: 2-hydroxyethyl 1-[2-(diisopropylamino)ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 1-[[2-[di(propan-2-yl)amino]ethylamino]-oxomethyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 1-[2-[di(propan-2-yl)amino]ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 1-[2-(diisopropylamino)ethylcarbamoyl]-6-phenoxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid 2-hydroxyethyl ester Formula: C27H37N3O5 MolecularWeight: 483.59978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OCCO)C=C(C=C2)OC3=CC=CC=C3)C(C)C

Isomeric SMILES

CC(C)N(CCNC(=O)C1C2=C(CCN1C(=O)OCCO)C=C(C=C2)OC3=CC=CC=C3)C(C)C

InChI

InChI=1S/C27H37N3O5/c1-19(2)29(20(3)4)15-13-28-26(32)25-24-11-10-23(35-22-8-6-5-7-9-22)18-21(24)12-14-30(25)27(33)34-17-16-31/h5-11,18-20,25,31H,12-17H2,1-4H3,(H,28,32)