butyl 4-[[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate

Systemtic Name: butyl 4-[[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Openeye Name: butyl 4-[[(E)-3-(6-methoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(6-methoxy-3-phenyl-5-benzofuranyl)-1-oxobut-2-enyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(E)-3-(6-methoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(6-methoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]amino]benzoic acid butyl ester Formula: C30H29NO5 MolecularWeight: 483.55496

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=C(C)C2=C(C=C3C(=C2)C(=CO3)C4=CC=CC=C4)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C(\C)/C2=C(C=C3C(=C2)C(=CO3)C4=CC=CC=C4)OC

InChI

InChI=1S/C30H29NO5/c1-4-5-15-35-30(33)22-11-13-23(14-12-22)31-29(32)16-20(2)24-17-25-26(21-9-7-6-8-10-21)19-36-28(25)18-27(24)34-3/h6-14,16-19H,4-5,15H2,1-3H3,(H,31,32)/b20-16+