1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]-1-methyl-pyrrol-2-yl]-4-(3,5-dimethylphenyl)butan-1-one

Systemtic Name: 1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]-1-methyl-pyrrol-2-yl]-4-(3,5-dimethylphenyl)butan-1-one Openeye Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methyl-pyrrol-2-yl]-4-(3,5-dimethylphenyl)butan-1-one CAS Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methyl-2-pyrrolyl]-4-(3,5-dimethylphenyl)-1-butanone IUPAC Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methylpyrrol-2-yl]-4-(3,5-dimethylphenyl)butan-1-one Traditional Name: 1-[5-(3-amino-3-methylol-pentyl)-1-methyl-pyrrol-2-yl]-4-(3,5-dimethylphenyl)butan-1-one Formula: C23H34N2O2 MolecularWeight: 370.52826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(N1C)C(=O)CCCC2=CC(=CC(=C2)C)C)(CO)N

Isomeric SMILES

CCC(CCC1=CC=C(N1C)C(=O)CCCC2=CC(=CC(=C2)C)C)(CO)N

InChI

InChI=1S/C23H34N2O2/c1-5-23(24,16-26)12-11-20-9-10-21(25(20)4)22(27)8-6-7-19-14-17(2)13-18(3)15-19/h9-10,13-15,26H,5-8,11-12,16,24H2,1-4H3