1-[1-[(4-chlorophenyl)methyl]-2,4-dimethyl-pyrrol-3-yl]octadecan-1-one

Systemtic Name: 1-[1-[(4-chlorophenyl)methyl]-2,4-dimethyl-pyrrol-3-yl]octadecan-1-one Openeye Name: 1-[1-[(4-chlorophenyl)methyl]-2,4-dimethyl-pyrrol-3-yl]octadecan-1-one CAS Name: 1-[1-[(4-chlorophenyl)methyl]-2,4-dimethyl-3-pyrrolyl]-1-octadecanone IUPAC Name: 1-[1-[(4-chlorophenyl)methyl]-2,4-dimethylpyrrol-3-yl]octadecan-1-one Traditional Name: 1-[1-(4-chlorobenzyl)-2,4-dimethyl-pyrrol-3-yl]octadecan-1-one Formula: C31H48ClNO MolecularWeight: 486.17192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)CC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(N(C=C1C)CC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C31H48ClNO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-30(34)31-26(2)24-33(27(31)3)25-28-20-22-29(32)23-21-28/h20-24H,4-19,25H2,1-3H3