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

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1-methyl-pyrrol-2-yl]-4-(3-methoxy-4-methyl-phenyl)butan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1-methyl-pyrrol-2-yl]-4-(3-methoxy-4-methyl-phenyl)butan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1-methyl-2-pyrrolyl]-4-(3-methoxy-4-methylphenyl)-1-butanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1-methylpyrrol-2-yl]-4-(3-methoxy-4-methylphenyl)butan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1-methyl-pyrrol-2-yl]-4-(3-methoxy-4-methyl-phenyl)butan-1-one Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCC(=O)C2=CC=C(N2C)CCC(C)(CO)N)OC

Isomeric SMILES

CC1=C(C=C(C=C1)CCCC(=O)C2=CC=C(N2C)CCC(C)(CO)N)OC

InChI

InChI=1S/C22H32N2O3/c1-16-8-9-17(14-21(16)27-4)6-5-7-20(26)19-11-10-18(24(19)3)12-13-22(2,23)15-25/h8-11,14,25H,5-7,12-13,15,23H2,1-4H3