2-[(4-decoxy-2,6-dimethyl-phenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole

Systemtic Name: 2-[(4-decoxy-2,6-dimethyl-phenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole Openeye Name: 2-[(4-decoxy-2,6-dimethyl-phenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole CAS Name: 2-[(4-decoxy-2,6-dimethylphenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole IUPAC Name: 2-[(4-decoxy-2,6-dimethylphenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole Traditional Name: 2-[(4-decoxy-2,6-dimethyl-phenyl)-(1H-pyrrol-2-yl)methyl]-1H-pyrrole Formula: C27H38N2O MolecularWeight: 406.60342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C(=C1)C)C(C2=CC=CN2)C3=CC=CN3)C

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C(=C1)C)C(C2=CC=CN2)C3=CC=CN3)C

InChI

InChI=1S/C27H38N2O/c1-4-5-6-7-8-9-10-11-18-30-23-19-21(2)26(22(3)20-23)27(24-14-12-16-28-24)25-15-13-17-29-25/h12-17,19-20,27-29H,4-11,18H2,1-3H3