(E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(3-methoxy-2-propan-2-yloxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrol-3-yl)carbonyl-3-(3-methoxy-2-propan-2-yloxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(2-isopropoxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(2,5-dimethyl-1-propyl-3-pyrrolyl)-oxomethyl]-3-(3-methoxy-2-propan-2-yloxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(2,5-dimethyl-1-propylpyrrole-3-carbonyl)-3-(3-methoxy-2-propan-2-yloxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(2,5-dimethyl-1-propyl-pyrrole-3-carbonyl)-3-(2-isopropoxy-3-methoxy-phenyl)acrylonitrile Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=CC(=C1C)C(=O)C(=CC2=C(C(=CC=C2)OC)OC(C)C)C#N)C

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O3/c1-7-11-25-16(4)12-20(17(25)5)22(26)19(14-24)13-18-9-8-10-21(27-6)23(18)28-15(2)3/h8-10,12-13,15H,7,11H2,1-6H3/b19-13+