3-[[4-[1-[(4-dimethylaminophenyl)amino]-3-oxidanylidene-2-benzofuran-1-yl]phenyl]-ethyl-amino]propyl 2-methylprop-2-enoate

Systemtic Name: 3-[[4-[1-[(4-dimethylaminophenyl)amino]-3-oxidanylidene-2-benzofuran-1-yl]phenyl]-ethyl-amino]propyl 2-methylprop-2-enoate Openeye Name: 3-[4-[1-[4-(dimethylamino)anilino]-3-oxo-isobenzofuran-1-yl]-N-ethyl-anilino]propyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 3-[4-[1-[4-(dimethylamino)anilino]-3-oxo-1-isobenzofuranyl]-N-ethylanilino]propyl ester IUPAC Name: 3-[4-[1-[4-(dimethylamino)anilino]-3-oxo-2-benzofuran-1-yl]-N-ethylanilino]propyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 3-[4-[1-[4-(dimethylamino)anilino]-3-keto-phthalan-1-yl]-N-ethyl-anilino]propyl ester Formula: C31H35N3O4 MolecularWeight: 513.6273

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCOC(=O)C(=C)C)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)NC4=CC=C(C=C4)N(C)C

Isomeric SMILES

CCN(CCCOC(=O)C(=C)C)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)NC4=CC=C(C=C4)N(C)C

InChI

InChI=1S/C31H35N3O4/c1-6-34(20-9-21-37-29(35)22(2)3)26-16-12-23(13-17-26)31(28-11-8-7-10-27(28)30(36)38-31)32-24-14-18-25(19-15-24)33(4)5/h7-8,10-19,32H,2,6,9,20-21H2,1,3-5H3