[2-[3-(dimethylamino)-4-methoxy-5-propan-2-yl-phenyl]-2-oxidanylidene-ethyl] 2-(3-azanyl-6-ethoxy-1H-isoindol-5-yl)ethanoate

Systemtic Name: [2-[3-(dimethylamino)-4-methoxy-5-propan-2-yl-phenyl]-2-oxidanylidene-ethyl] 2-(3-azanyl-6-ethoxy-1H-isoindol-5-yl)ethanoate Openeye Name: [2-[3-(dimethylamino)-5-isopropyl-4-methoxy-phenyl]-2-oxo-ethyl] 2-(3-amino-6-ethoxy-1H-isoindol-5-yl)acetate CAS Name: 2-(3-amino-6-ethoxy-1H-isoindol-5-yl)acetic acid [2-[3-(dimethylamino)-4-methoxy-5-propan-2-ylphenyl]-2-oxoethyl] ester IUPAC Name: [2-[3-(dimethylamino)-4-methoxy-5-propan-2-ylphenyl]-2-oxoethyl] 2-(3-amino-6-ethoxy-1H-isoindol-5-yl)acetate Traditional Name: 2-(3-amino-6-ethoxy-1H-isoindol-5-yl)acetic acid [2-[3-(dimethylamino)-5-isopropyl-4-methoxy-phenyl]-2-keto-ethyl] ester Formula: C26H33N3O5 MolecularWeight: 467.55732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CN=C2N)CC(=O)OCC(=O)C3=CC(=C(C(=C3)N(C)C)OC)C(C)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CN=C2N)CC(=O)OCC(=O)C3=CC(=C(C(=C3)N(C)C)OC)C(C)C

InChI

InChI=1S/C26H33N3O5/c1-7-33-23-11-18-13-28-26(27)20(18)9-17(23)12-24(31)34-14-22(30)16-8-19(15(2)3)25(32-6)21(10-16)29(4)5/h8-11,15H,7,12-14H2,1-6H3,(H2,27,28)