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

Systemtic Name: 1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]-1-methyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one Openeye Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one CAS Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methyl-2-pyrrolyl]-4-(3,4-dimethoxyphenyl)-1-butanone IUPAC Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-1-methylpyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one Traditional Name: 1-[5-(3-amino-3-methylol-pentyl)-1-methyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one Formula: C23H34N2O4 MolecularWeight: 402.52706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N2O4/c1-5-23(24,16-26)14-13-18-10-11-19(25(18)2)20(27)8-6-7-17-9-12-21(28-3)22(15-17)29-4/h9-12,15,26H,5-8,13-14,16,24H2,1-4H3