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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(N1)C=C2C(=CC(=C3C=CC=N3)N2)OC

Isomeric SMILES

CCCCCCCC1=CC=C(N1)/C=C\2/C(=C/C(=C/3\C=CC=N3)/N2)OC

InChI

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