ethyl 3-[5-azanyl-4,6-dimethyl-3-(4-propan-2-ylphenyl)-2,3-dihydro-1-benzofuran-7-yl]propanoate

Systemtic Name: ethyl 3-[5-azanyl-4,6-dimethyl-3-(4-propan-2-ylphenyl)-2,3-dihydro-1-benzofuran-7-yl]propanoate Openeye Name: ethyl 3-[5-amino-3-(4-isopropylphenyl)-4,6-dimethyl-2,3-dihydrobenzofuran-7-yl]propanoate CAS Name: 3-[5-amino-4,6-dimethyl-3-(4-propan-2-ylphenyl)-2,3-dihydrobenzofuran-7-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[5-amino-4,6-dimethyl-3-(4-propan-2-ylphenyl)-2,3-dihydro-1-benzofuran-7-yl]propanoate Traditional Name: 3-(5-amino-4,6-dimethyl-3-p-cumenyl-coumaran-7-yl)propionic acid ethyl ester Formula: C24H31NO3 MolecularWeight: 381.50784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C2C(=C(C(=C1C)N)C)C(CO2)C3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCOC(=O)CCC1=C2C(=C(C(=C1C)N)C)C(CO2)C3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C24H31NO3/c1-6-27-21(26)12-11-19-15(4)23(25)16(5)22-20(13-28-24(19)22)18-9-7-17(8-10-18)14(2)3/h7-10,14,20H,6,11-13,25H2,1-5H3