ethanedioic acid; 9-ethyl-3-[[4-(naphthalen-2-ylmethyl)piperazin-1-yl]methyl]carbazole

Systemtic Name: ethanedioic acid; 9-ethyl-3-[[4-(naphthalen-2-ylmethyl)piperazin-1-yl]methyl]carbazole Openeye Name: 9-ethyl-3-[[4-(2-naphthylmethyl)piperazin-1-yl]methyl]carbazole; oxalic acid CAS Name: 9-ethyl-3-[[4-(2-naphthalenylmethyl)-1-piperazinyl]methyl]carbazole; oxalic acid IUPAC Name: 9-ethyl-3-[[4-(naphthalen-2-ylmethyl)piperazin-1-yl]methyl]carbazole; oxalic acid Traditional Name: 9-ethyl-3-[[4-(2-naphthylmethyl)piperazino]methyl]carbazole; oxalic acid Formula: C32H33N3O4 MolecularWeight: 523.62212

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC5=CC=CC=C5C=C4)C6=CC=CC=C61.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC5=CC=CC=C5C=C4)C6=CC=CC=C61.C(=O)(C(=O)O)O

InChI

InChI=1S/C30H31N3.C2H2O4/c1-2-33-29-10-6-5-9-27(29)28-20-24(12-14-30(28)33)22-32-17-15-31(16-18-32)21-23-11-13-25-7-3-4-8-26(25)19-23;3-1(4)2(5)6/h3-14,19-20H,2,15-18,21-22H2,1H3;(H,3,4)(H,5,6)