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

Systemtic Name: 2-[5-aminocarbonyl-9-(phenylmethyl)pyrido[3,4-b]indol-4-yl]oxyethanoic acid Openeye Name: 2-(9-benzyl-5-carbamoyl-pyrido[3,4-b]indol-4-yl)oxyacetic acid CAS Name: 2-[[5-carbamoyl-9-(phenylmethyl)-4-pyrido[3,4-b]indolyl]oxy]acetic acid IUPAC Name: 2-(9-benzyl-5-carbamoylpyrido[3,4-b]indol-4-yl)oxyacetic acid Traditional Name: 2-[(9-benzyl-5-carbamoyl-$b-carbolin-4-yl)oxy]acetic acid Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=CC=CC(=C3C4=C(C=NC=C42)OCC(=O)O)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=CC=CC(=C3C4=C(C=NC=C42)OCC(=O)O)C(=O)N

InChI

InChI=1S/C21H17N3O4/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/h1-10H,11-12H2,(H2,22,27)(H,25,26)