2-[5-aminocarbonyl-9-(cyclohexylmethyl)pyrido[3,4-b]indol-4-yl]oxyethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-(cyclohexylmethyl)pyrido[3,4-b]indol-4-yl]oxyethanoic acid Openeye Name: 2-[5-carbamoyl-9-(cyclohexylmethyl)pyrido[3,4-b]indol-4-yl]oxyacetic acid CAS Name: 2-[[5-carbamoyl-9-(cyclohexylmethyl)-4-pyrido[3,4-b]indolyl]oxy]acetic acid IUPAC Name: 2-[5-carbamoyl-9-(cyclohexylmethyl)pyrido[3,4-b]indol-4-yl]oxyacetic acid Traditional Name: 2-[[5-carbamoyl-9-(cyclohexylmethyl)-$b-carbolin-4-yl]oxy]acetic acid Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=CC=CC(=C3C4=C(C=NC=C42)OCC(=O)O)C(=O)N

Isomeric SMILES

C1CCC(CC1)CN2C3=CC=CC(=C3C4=C(C=NC=C42)OCC(=O)O)C(=O)N

InChI

InChI=1S/C21H23N3O4/c22-21(27)14-7-4-8-15-19(14)20-16(9-23-10-17(20)28-12-18(25)26)24(15)11-13-5-2-1-3-6-13/h4,7-10,13H,1-3,5-6,11-12H2,(H2,22,27)(H,25,26)