ethanedioic acid; 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: ethanedioic acid; 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]-3-methyl-butan-1-one; oxalic acid CAS Name: 1-[4-[(9-ethyl-3-carbazolyl)methyl]-1-piperazinyl]-3-methyl-1-butanone; oxalic acid IUPAC Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazin-1-yl]-3-methylbutan-1-one; oxalic acid Traditional Name: 1-[4-[(9-ethylcarbazol-3-yl)methyl]piperazino]-3-methyl-butan-1-one; oxalic acid Formula: C26H33N3O5 MolecularWeight: 467.55732

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)CC(C)C)C4=CC=CC=C41.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)CN3CCN(CC3)C(=O)CC(C)C)C4=CC=CC=C41.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H31N3O.C2H2O4/c1-4-27-22-8-6-5-7-20(22)21-16-19(9-10-23(21)27)17-25-11-13-26(14-12-25)24(28)15-18(2)3;3-1(4)2(5)6/h5-10,16,18H,4,11-15,17H2,1-3H3;(H,3,4)(H,5,6)