(2E)-3-ethoxy-1-methyl-5-(5-methyl-1H-pyrrol-2-yl)-2-(5-undec-10-enylpyrrol-2-ylidene)-3H-pyrrole-4-carboxylic acid

Systemtic Name: (2E)-3-ethoxy-1-methyl-5-(5-methyl-1H-pyrrol-2-yl)-2-(5-undec-10-enylpyrrol-2-ylidene)-3H-pyrrole-4-carboxylic acid Openeye Name: (2E)-3-ethoxy-1-methyl-5-(5-methyl-1H-pyrrol-2-yl)-2-(5-undec-10-enylpyrrol-2-ylidene)-3H-pyrrole-4-carboxylic acid CAS Name: (2E)-3-ethoxy-1-methyl-5-(5-methyl-1H-pyrrol-2-yl)-2-(5-undec-10-enyl-2-pyrrolylidene)-3H-pyrrole-4-carboxylic acid IUPAC Name: (2E)-3-ethoxy-1-methyl-5-(5-methyl-1H-pyrrol-2-yl)-2-(5-undec-10-enylpyrrol-2-ylidene)-3H-pyrrole-4-carboxylic acid Traditional Name: (5E)-4-ethoxy-1-methyl-2-(5-methyl-1H-pyrrol-2-yl)-5-(5-undec-10-enylpyrrol-2-ylidene)-2-pyrroline-3-carboxylic acid Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C(=C(N(C1=C2C=CC(=N2)CCCCCCCCCC=C)C)C3=CC=C(N3)C)C(=O)O

Isomeric SMILES

CCOC\1C(=C(N(/C1=C/2\C=CC(=N2)CCCCCCCCCC=C)C)C3=CC=C(N3)C)C(=O)O

InChI

InChI=1S/C28H39N3O3/c1-5-7-8-9-10-11-12-13-14-15-21-17-19-23(30-21)26-27(34-6-2)24(28(32)33)25(31(26)4)22-18-16-20(3)29-22/h5,16-19,27,29H,1,6-15H2,2-4H3,(H,32,33)/b26-23+