1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]-4-chloranyl-1-methyl-pyrrol-2-yl]-5-phenyl-pentan-1-one

Systemtic Name: 1-[5-[3-azanyl-3-(hydroxymethyl)pentyl]-4-chloranyl-1-methyl-pyrrol-2-yl]-5-phenyl-pentan-1-one Openeye Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-4-chloro-1-methyl-pyrrol-2-yl]-5-phenyl-pentan-1-one CAS Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-4-chloro-1-methyl-2-pyrrolyl]-5-phenyl-1-pentanone IUPAC Name: 1-[5-[3-amino-3-(hydroxymethyl)pentyl]-4-chloro-1-methylpyrrol-2-yl]-5-phenylpentan-1-one Traditional Name: 1-[5-(3-amino-3-methylol-pentyl)-4-chloro-1-methyl-pyrrol-2-yl]-5-phenyl-pentan-1-one Formula: C22H31ClN2O2 MolecularWeight: 390.94674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=C(C=C(N1C)C(=O)CCCCC2=CC=CC=C2)Cl)(CO)N

Isomeric SMILES

CCC(CCC1=C(C=C(N1C)C(=O)CCCCC2=CC=CC=C2)Cl)(CO)N

InChI

InChI=1S/C22H31ClN2O2/c1-3-22(24,16-26)14-13-19-18(23)15-20(25(19)2)21(27)12-8-7-11-17-9-5-4-6-10-17/h4-6,9-10,15,26H,3,7-8,11-14,16,24H2,1-2H3