1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid

Systemtic Name: 1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid Openeye Name: 1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid CAS Name: 1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid IUPAC Name: 1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylic acid Traditional Name: 1-(2-carboxyethyl)-4-phenyl-2,3,4,9-tetrahydro-$b-carboline-1-carboxylic acid Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C(N1)(CCC(=O)O)C(=O)O)NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1C(C2=C(C(N1)(CCC(=O)O)C(=O)O)NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H20N2O4/c24-17(25)10-11-21(20(26)27)19-18(14-8-4-5-9-16(14)23-19)15(12-22-21)13-6-2-1-3-7-13/h1-9,15,22-23H,10-12H2,(H,24,25)(H,26,27)