1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1,4-dimethyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one

Systemtic Name: 1-[5-(3-azanyl-3-methyl-4-oxidanyl-butyl)-1,4-dimethyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one Openeye Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1,4-dimethyl-pyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one CAS Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1,4-dimethyl-2-pyrrolyl]-4-(3,4-dimethoxyphenyl)-1-butanone IUPAC Name: 1-[5-(3-amino-4-hydroxy-3-methylbutyl)-1,4-dimethylpyrrol-2-yl]-4-(3,4-dimethoxyphenyl)butan-1-one Traditional Name: 1-[5-(3-amino-4-hydroxy-3-methyl-butyl)-1,4-dimethyl-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:

CC1=C(N(C(=C1)C(=O)CCCC2=CC(=C(C=C2)OC)OC)C)CCC(C)(CO)N

Isomeric SMILES

CC1=C(N(C(=C1)C(=O)CCCC2=CC(=C(C=C2)OC)OC)C)CCC(C)(CO)N

InChI

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