1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1H-pyrrol-2-yl]-5-phenyl-pentan-1-one

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1H-pyrrol-2-yl]-5-phenyl-pentan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1H-pyrrol-2-yl]-5-phenyl-pentan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1H-pyrrol-2-yl]-5-phenyl-1-pentanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1H-pyrrol-2-yl]-5-phenylpentan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1H-pyrrol-2-yl]-5-phenyl-pentan-1-one Formula: C20H28N2O2 MolecularWeight: 328.44852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(N1)C(=O)CCCCC2=CC=CC=C2)(CO)N

Isomeric SMILES

CC(CCC1=CC=C(N1)C(=O)CCCCC2=CC=CC=C2)(CO)N

InChI

InChI=1S/C20H28N2O2/c1-20(21,15-23)14-13-17-11-12-18(22-17)19(24)10-6-5-9-16-7-3-2-4-8-16/h2-4,7-8,11-12,22-23H,5-6,9-10,13-15,21H2,1H3