3-(dimethylamino)propyl 2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-2-oxidanyl-3-phenyl-propanoate

Systemtic Name: 3-(dimethylamino)propyl 2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-2-oxidanyl-3-phenyl-propanoate Openeye Name: 3-(dimethylamino)propyl 2-(2,2-dimethyl-3H-benzofuran-7-yl)-2-hydroxy-3-phenyl-propanoate CAS Name: 2-(2,2-dimethyl-3H-benzofuran-7-yl)-2-hydroxy-3-phenylpropanoic acid 3-(dimethylamino)propyl ester IUPAC Name: 3-(dimethylamino)propyl 2-(2,2-dimethyl-3H-1-benzofuran-7-yl)-2-hydroxy-3-phenylpropanoate Traditional Name: 2-(2,2-dimethylcoumaran-7-yl)-2-hydroxy-3-phenyl-propionic acid 3-(dimethylamino)propyl ester Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)C(CC3=CC=CC=C3)(C(=O)OCCCN(C)C)O)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)C(CC3=CC=CC=C3)(C(=O)OCCCN(C)C)O)C

InChI

InChI=1S/C24H31NO4/c1-23(2)17-19-12-8-13-20(21(19)29-23)24(27,16-18-10-6-5-7-11-18)22(26)28-15-9-14-25(3)4/h5-8,10-13,27H,9,14-17H2,1-4H3