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

Systemtic Name: ethanedioic acid; 9-ethyl-3-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]carbazole Openeye Name: 9-ethyl-3-[[4-(1-naphthylmethyl)piperazin-1-yl]methyl]carbazole; oxalic acid CAS Name: 9-ethyl-3-[[4-(1-naphthalenylmethyl)-1-piperazinyl]methyl]carbazole; oxalic acid IUPAC Name: 9-ethyl-3-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]methyl]carbazole; oxalic acid Traditional Name: 9-ethyl-3-[[4-(1-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=CC=CC5=CC=CC=C54)C6=CC=CC=C61.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)CC4=CC=CC5=CC=CC=C54)C6=CC=CC=C61.C(=O)(C(=O)O)O

InChI

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