(2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-5-pyrrol-2-ylidene-pyrrole

Systemtic Name: (2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-5-pyrrol-2-ylidene-pyrrole Openeye Name: (2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylene]-3-methoxy-5-pyrrol-2-ylidene-pyrrole CAS Name: (2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-5-(2-pyrrolylidene)pyrrole IUPAC Name: (2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylidene]-3-methoxy-5-pyrrol-2-ylidenepyrrole Traditional Name: (2Z,5Z)-2-[(4-hexyl-5-methyl-1H-pyrrol-2-yl)methylene]-3-methoxy-5-pyrrol-2-ylidene-3-pyrroline Formula: C21H27N3O MolecularWeight: 337.45858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(NC(=C1)C=C2C(=CC(=C3C=CC=N3)N2)OC)C

Isomeric SMILES

CCCCCCC1=C(NC(=C1)/C=C\2/C(=C/C(=C/3\C=CC=N3)/N2)OC)C

InChI

InChI=1S/C21H27N3O/c1-4-5-6-7-9-16-12-17(23-15(16)2)13-20-21(25-3)14-19(24-20)18-10-8-11-22-18/h8,10-14,23-24H,4-7,9H2,1-3H3/b19-18-,20-13-