2-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)carbonylamino]terephthalic acid

Systemtic Name: 2-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)carbonylamino]terephthalic acid Openeye Name: 2-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]terephthalic acid CAS Name: 2-[[(6-methyl-6,7,8,9-tetrahydro-5H-carbazol-3-yl)-oxomethyl]amino]terephthalic acid IUPAC Name: 2-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]terephthalic acid Traditional Name: 2-[(6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carbonyl)amino]terephthalic acid Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C22H20N2O5/c1-11-2-6-17-15(8-11)16-9-12(4-7-18(16)23-17)20(25)24-19-10-13(21(26)27)3-5-14(19)22(28)29/h3-5,7,9-11,23H,2,6,8H2,1H3,(H,24,25)(H,26,27)(H,28,29)