N,N-diethyl-4-[[5-(hydroxymethyl)-2-methyl-4-prop-2-enyl-piperazin-1-yl]-(3-methoxyphenyl)methyl]benzamide

Systemtic Name: N,N-diethyl-4-[[5-(hydroxymethyl)-2-methyl-4-prop-2-enyl-piperazin-1-yl]-(3-methoxyphenyl)methyl]benzamide Openeye Name: 4-[[4-allyl-5-(hydroxymethyl)-2-methyl-piperazin-1-yl]-(3-methoxyphenyl)methyl]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-4-[[5-(hydroxymethyl)-2-methyl-4-prop-2-enyl-1-piperazinyl]-(3-methoxyphenyl)methyl]benzamide IUPAC Name: N,N-diethyl-4-[[5-(hydroxymethyl)-2-methyl-4-prop-2-enylpiperazin-1-yl]-(3-methoxyphenyl)methyl]benzamide Traditional Name: 4-[(4-allyl-2-methyl-5-methylol-piperazino)-(3-methoxyphenyl)methyl]-N,N-diethyl-benzamide Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)OC)N3CC(N(CC3C)CC=C)CO

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)OC)N3CC(N(CC3C)CC=C)CO

InChI

InChI=1S/C28H39N3O3/c1-6-16-30-18-21(4)31(19-25(30)20-32)27(24-10-9-11-26(17-24)34-5)22-12-14-23(15-13-22)28(33)29(7-2)8-3/h6,9-15,17,21,25,27,32H,1,7-8,16,18-20H2,2-5H3