(2E,5Z)-3-phenylmethoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrole hydrochloride

Systemtic Name: (2E,5Z)-3-phenylmethoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrole hydrochloride Openeye Name: (2E,5Z)-3-benzyloxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1H-pyrrol-2-yl)methylene]pyrrole hydrochloride CAS Name: (2E,5Z)-3-phenylmethoxy-5-(2-pyrrolylidene)-2-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrole hydrochloride IUPAC Name: (2E,5Z)-3-phenylmethoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1H-pyrrol-2-yl)methylidene]pyrrole hydrochloride Traditional Name: (2E,5Z)-3-benzoxy-5-pyrrol-2-ylidene-2-[(5-undecyl-1H-pyrrol-2-yl)methylene]-3-pyrroline hydrochloride Formula: C31H40ClN3O MolecularWeight: 506.1218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CC=C(N1)C=C2C(=CC(=C3C=CC=N3)N2)OCC4=CC=CC=C4.Cl

Isomeric SMILES

CCCCCCCCCCCC1=CC=C(N1)/C=C/2\C(=C/C(=C/3\C=CC=N3)/N2)OCC4=CC=CC=C4.Cl

InChI

InChI=1S/C31H39N3O.ClH/c1-2-3-4-5-6-7-8-9-13-17-26-19-20-27(33-26)22-30-31(35-24-25-15-11-10-12-16-25)23-29(34-30)28-18-14-21-32-28;/h10-12,14-16,18-23,33-34H,2-9,13,17,24H2,1H3;1H/b29-28-,30-22+;