2-diethylaminoethyl (Z)-2-(6-fluoranyl-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoate

Systemtic Name: 2-diethylaminoethyl (Z)-2-(6-fluoranyl-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoate Openeye Name: 2-diethylaminoethyl (Z)-2-(6-fluoro-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoate CAS Name: (Z)-2-(6-fluoro-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)-2-propenoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl (Z)-2-(6-fluoro-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)prop-2-enoate Traditional Name: (Z)-2-(6-fluoro-2-methyl-3H-inden-1-yl)-3-(4-methylsulfinylphenyl)acrylic acid 2-diethylaminoethyl ester Formula: C26H30FNO3S MolecularWeight: 455.584703

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C(=CC1=CC=C(C=C1)S(=O)C)C2=C(CC3=C2C=C(C=C3)F)C

Isomeric SMILES

CCN(CC)CCOC(=O)/C(=C\C1=CC=C(C=C1)S(=O)C)/C2=C(CC3=C2C=C(C=C3)F)C

InChI

InChI=1S/C26H30FNO3S/c1-5-28(6-2)13-14-31-26(29)24(16-19-7-11-22(12-8-19)32(4)30)25-18(3)15-20-9-10-21(27)17-23(20)25/h7-12,16-17H,5-6,13-15H2,1-4H3/b24-16-