6-iodanyl-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid

Systemtic Name: 6-iodanyl-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Openeye Name: 6-iodo-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid CAS Name: 6-iodo-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid IUPAC Name: 6-iodo-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Traditional Name: 6-iodo-4-(4-methoxyphenyl)-3-methyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Formula: C18H18INO3 MolecularWeight: 423.24489

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C=CC(=C2)I)NC1C(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1C(C2=C(C=CC(=C2)I)NC1C(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C18H18INO3/c1-10-16(11-3-6-13(23-2)7-4-11)14-9-12(19)5-8-15(14)20-17(10)18(21)22/h3-10,16-17,20H,1-2H3,(H,21,22)