(diphenylmethyl) (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate

Systemtic Name: (diphenylmethyl) (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate Openeye Name: benzhydryl (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)prop-2-enoate CAS Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-3-pyrrolyl)-2-propenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (E)-2-cyano-3-(2,5-dimethyl-1-propylpyrrol-3-yl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(2,5-dimethyl-1-propyl-pyrrol-3-yl)acrylic acid benzhydryl ester Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C=C(C#N)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)C

Isomeric SMILES

CCCN1C(=CC(=C1C)/C=C(\C#N)/C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)C

InChI

InChI=1S/C26H26N2O2/c1-4-15-28-19(2)16-23(20(28)3)17-24(18-27)26(29)30-25(21-11-7-5-8-12-21)22-13-9-6-10-14-22/h5-14,16-17,25H,4,15H2,1-3H3/b24-17+