5-[(4-chlorophenyl)methyl]-4-ethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid

Systemtic Name: 5-[(4-chlorophenyl)methyl]-4-ethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Openeye Name: 5-[(4-chlorophenyl)methyl]-4-ethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid CAS Name: 5-[(4-chlorophenyl)methyl]-4-ethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid IUPAC Name: 5-[(4-chlorophenyl)methyl]-4-ethyl-9H-pyrido[3,4-b]indole-3-carboxylic acid Traditional Name: 5-(4-chlorobenzyl)-4-ethyl-9H-$b-carboline-3-carboxylic acid Formula: C21H17ClN2O2 MolecularWeight: 364.82488

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CN=C1C(=O)O)NC3=CC=CC(=C32)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C2C(=CN=C1C(=O)O)NC3=CC=CC(=C32)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H17ClN2O2/c1-2-15-19-17(11-23-20(15)21(25)26)24-16-5-3-4-13(18(16)19)10-12-6-8-14(22)9-7-12/h3-9,11,24H,2,10H2,1H3,(H,25,26)