2-dimethylaminoethyl 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]carbonyl-1-benzofuran-5-carboxylate

Systemtic Name: 2-dimethylaminoethyl 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]carbonyl-1-benzofuran-5-carboxylate Openeye Name: 2-dimethylaminoethyl 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]benzofuran-5-carboxylate CAS Name: 2-butyl-3-[[4-[(E)-3-(dibutylamino)prop-1-enyl]phenyl]-oxomethyl]-5-benzofurancarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]-1-benzofuran-5-carboxylate Traditional Name: 2-butyl-3-[4-[(E)-3-(dibutylamino)prop-1-enyl]benzoyl]benzofuran-5-carboxylic acid 2-dimethylaminoethyl ester Formula: C35H48N2O4 MolecularWeight: 560.76662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC1=C(C2=C(O1)C=CC(=C2)C(=O)OCCN(C)C)C(=O)C3=CC=C(C=C3)/C=C/CN(CCCC)CCCC

InChI

InChI=1S/C35H48N2O4/c1-6-9-14-32-33(30-26-29(19-20-31(30)41-32)35(39)40-25-24-36(4)5)34(38)28-17-15-27(16-18-28)13-12-23-37(21-10-7-2)22-11-8-3/h12-13,15-20,26H,6-11,14,21-25H2,1-5H3/b13-12+