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

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1-ethyl-pyrrol-2-yl]-4-phenyl-butan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1-ethyl-pyrrol-2-yl]-4-phenyl-butan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1-ethyl-2-pyrrolyl]-4-phenyl-1-butanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1-ethylpyrrol-2-yl]-4-phenylbutan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1-ethyl-pyrrol-2-yl]-4-phenyl-butan-1-one Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=C1C(=O)CCCC2=CC=CC=C2)CCC(C)(CO)N

Isomeric SMILES

CCN1C(=CC=C1C(=O)CCCC2=CC=CC=C2)CCC(C)(CO)N

InChI

InChI=1S/C21H30N2O2/c1-3-23-18(14-15-21(2,22)16-24)12-13-19(23)20(25)11-7-10-17-8-5-4-6-9-17/h4-6,8-9,12-13,24H,3,7,10-11,14-16,22H2,1-2H3