2-(3-azanylpiperazin-1-yl)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]butan-1-one

Systemtic Name: 2-(3-azanylpiperazin-1-yl)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]butan-1-one Openeye Name: 2-(3-aminopiperazin-1-yl)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]butan-1-one CAS Name: 2-(3-amino-1-piperazinyl)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]-1-butanone IUPAC Name: 2-(3-aminopiperazin-1-yl)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]butan-1-one Traditional Name: 2-(3-aminopiperazino)-1-[2-(3,4,5-trimethoxyphenyl)phenyl]butan-1-one Formula: C23H31N3O4 MolecularWeight: 413.50994

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1C2=CC(=C(C(=C2)OC)OC)OC)N3CCNC(C3)N

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1C2=CC(=C(C(=C2)OC)OC)OC)N3CCNC(C3)N

InChI

InChI=1S/C23H31N3O4/c1-5-18(26-11-10-25-21(24)14-26)22(27)17-9-7-6-8-16(17)15-12-19(28-2)23(30-4)20(13-15)29-3/h6-9,12-13,18,21,25H,5,10-11,14,24H2,1-4H3