9H-fluoren-9-yl (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enoate

Systemtic Name: 9H-fluoren-9-yl (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enoate Openeye Name: 9H-fluoren-9-yl (E)-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)-3-pyrrolyl]-2-propenoic acid 9H-fluoren-9-yl ester IUPAC Name: 9H-fluoren-9-yl (E)-2-cyano-3-[2,5-dimethyl-1-(2-methylpropyl)pyrrol-3-yl]prop-2-enoate Traditional Name: (E)-2-cyano-3-(1-isobutyl-2,5-dimethyl-pyrrol-3-yl)acrylic acid 9H-fluoren-9-yl ester Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC(C)C)C)C=C(C#N)C(=O)OC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC1=CC(=C(N1CC(C)C)C)/C=C(\C#N)/C(=O)OC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C27H26N2O2/c1-17(2)16-29-18(3)13-20(19(29)4)14-21(15-28)27(30)31-26-24-11-7-5-9-22(24)23-10-6-8-12-25(23)26/h5-14,17,26H,16H2,1-4H3/b21-14+