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1-(9H-xanthen-9-ylcarbonyl)piperazine-2,3-dicarboxylic acid

1-(9H-xanthen-9-ylcarbonyl)piperazine-2,3-dicarboxylic acid

Systemtic Name:1-(9H-xanthen-9-ylcarbonyl)piperazine-2,3-dicarboxylic acid
Openeye Name:1-(9H-xanthene-9-carbonyl)piperazine-2,3-dicarboxylic acid
CAS Name:1-[oxo(9H-xanthen-9-yl)methyl]piperazine-2,3-dicarboxylic acid
IUPAC Name:1-(9H-xanthene-9-carbonyl)piperazine-2,3-dicarboxylic acid
Traditional Name:1-(9H-xanthene-9-carbonyl)piperazine-2,3-dicarboxylic acid
Formula: C20H18N2O6
MolecularWeight: 382.36672
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(N1)C(=O)O)C(=O)O)C(=O)C2C3=CC=CC=C3OC4=CC=CC=C24


Isomeric SMILES

C1CN(C(C(N1)C(=O)O)C(=O)O)C(=O)C2C3=CC=CC=C3OC4=CC=CC=C24


InChI

InChI=1S/C20H18N2O6/c23-18(22-10-9-21-16(19(24)25)17(22)20(26)27)15-11-5-1-3-7-13(11)28-14-8-4-2-6-12(14)15/h1-8,15-17,21H,9-10H2,(H,24,25)(H,26,27)


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