N-[5-methyl-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-morpholin-4-yl-benzamide; 2-oxidanylethanoate

Systemtic Name: N-[5-methyl-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-morpholin-4-yl-benzamide; 2-oxidanylethanoate Openeye Name: 2-hydroxyacetate; N-[5-methyl-8-(4-methylpiperazin-1-yl)tetralin-2-yl]-4-morpholino-benzamide CAS Name: 2-hydroxyacetate; N-[5-methyl-8-(4-methyl-1-piperazinyl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-(4-morpholinyl)benzamide IUPAC Name: 2-hydroxyacetate; N-[5-methyl-8-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydronaphthalen-2-yl]-4-morpholin-4-ylbenzamide Traditional Name: glycolate; N-[5-methyl-8-(4-methylpiperazino)tetralin-2-yl]-4-morpholino-benzamide Formula: C29H39N4O5- MolecularWeight: 523.64376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCC(CC2=C(C=C1)N3CCN(CC3)C)NC(=O)C4=CC=C(C=C4)N5CCOCC5.C(C(=O)[O-])O

Isomeric SMILES

CC1=C2CCC(CC2=C(C=C1)N3CCN(CC3)C)NC(=O)C4=CC=C(C=C4)N5CCOCC5.C(C(=O)[O-])O

InChI

InChI=1S/C27H36N4O2.C2H4O3/c1-20-3-10-26(31-13-11-29(2)12-14-31)25-19-22(6-9-24(20)25)28-27(32)21-4-7-23(8-5-21)30-15-17-33-18-16-30;3-1-2(4)5/h3-5,7-8,10,22H,6,9,11-19H2,1-2H3,(H,28,32);3H,1H2,(H,4,5)/p-1