propan-2-yl 2-butyl-3-[3-[3-(dibutylamino)prop-1-ynyl]phenyl]carbonyl-1-benzofuran-5-carboxylate

Systemtic Name: propan-2-yl 2-butyl-3-[3-[3-(dibutylamino)prop-1-ynyl]phenyl]carbonyl-1-benzofuran-5-carboxylate Openeye Name: isopropyl 2-butyl-3-[3-[3-(dibutylamino)prop-1-ynyl]benzoyl]benzofuran-5-carboxylate CAS Name: 2-butyl-3-[[3-[3-(dibutylamino)prop-1-ynyl]phenyl]-oxomethyl]-5-benzofurancarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-butyl-3-[3-[3-(dibutylamino)prop-1-ynyl]benzoyl]-1-benzofuran-5-carboxylate Traditional Name: 2-butyl-3-[3-[3-(dibutylamino)prop-1-ynyl]benzoyl]benzofuran-5-carboxylic acid isopropyl ester Formula: C34H43NO4 MolecularWeight: 529.70952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC(C)C)C(=O)C3=CC=CC(=C3)C#CCN(CCCC)CCCC

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OC(C)C)C(=O)C3=CC=CC(=C3)C#CCN(CCCC)CCCC

InChI

InChI=1S/C34H43NO4/c1-6-9-17-31-32(29-24-28(18-19-30(29)39-31)34(37)38-25(4)5)33(36)27-16-12-14-26(23-27)15-13-22-35(20-10-7-2)21-11-8-3/h12,14,16,18-19,23-25H,6-11,17,20-22H2,1-5H3