N,N-dibutyl-4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxy-aniline

Systemtic Name: N,N-dibutyl-4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxy-aniline Openeye Name: N,N-dibutyl-4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxy-aniline CAS Name: N,N-dibutyl-4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxyaniline IUPAC Name: N,N-dibutyl-4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxyaniline Traditional Name: dibutyl-[4-[(4-dimethylaminophenyl)-(1H-pyrrol-2-yl)methyl]-3-ethoxy-phenyl]amine Formula: C29H41N3O MolecularWeight: 447.65534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CN3)OCC

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CN3)OCC

InChI

InChI=1S/C29H41N3O/c1-6-9-20-32(21-10-7-2)25-17-18-26(28(22-25)33-8-3)29(27-12-11-19-30-27)23-13-15-24(16-14-23)31(4)5/h11-19,22,29-30H,6-10,20-21H2,1-5H3