[2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(5,6-dimethyl-1-benzofuran-3-yl)ethanoate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(5,6-dimethylbenzofuran-3-yl)acetate CAS Name: 2-(5,6-dimethyl-3-benzofuranyl)acetic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(5,6-dimethyl-1-benzofuran-3-yl)acetate Traditional Name: 2-(5,6-dimethylbenzofuran-3-yl)acetic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC(=O)NCCCC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CO2)CC(=O)OCC(=O)NCCCC3=CC=CC=C3)C

InChI

InChI=1S/C23H25NO4/c1-16-11-20-19(14-27-21(20)12-17(16)2)13-23(26)28-15-22(25)24-10-6-9-18-7-4-3-5-8-18/h3-5,7-8,11-12,14H,6,9-10,13,15H2,1-2H3,(H,24,25)