ethanedioic acid; N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-1-(phenylmethyl)piperidin-4-amine

Systemtic Name: ethanedioic acid; N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-1-(phenylmethyl)piperidin-4-amine Openeye Name: 1-benzyl-N-[(4-morpholinosulfonylphenyl)methyl]piperidin-4-amine; oxalic acid CAS Name: N-[[4-(4-morpholinylsulfonyl)phenyl]methyl]-1-(phenylmethyl)-4-piperidinamine; oxalic acid IUPAC Name: 1-benzyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]piperidin-4-amine; oxalic acid Traditional Name: (1-benzyl-4-piperidyl)-(4-morpholinosulfonylbenzyl)amine; oxalic acid Formula: C27H35N3O11S MolecularWeight: 609.6453

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1NCC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)CC4=CC=CC=C4.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H31N3O3S.2C2H2O4/c27-30(28,26-14-16-29-17-15-26)23-8-6-20(7-9-23)18-24-22-10-12-25(13-11-22)19-21-4-2-1-3-5-21;2*3-1(4)2(5)6/h1-9,22,24H,10-19H2;2*(H,3,4)(H,5,6)