2-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethyl)pyrrolo[3,2-c]pyridin-4-yl]oxyethanoic acid

Systemtic Name: 2-[3-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-1-(phenylmethyl)pyrrolo[3,2-c]pyridin-4-yl]oxyethanoic acid Openeye Name: 2-[3-(2-amino-2-oxo-ethyl)-1-benzyl-2-methyl-pyrrolo[3,2-c]pyridin-4-yl]oxyacetic acid CAS Name: 2-[[3-(2-amino-2-oxoethyl)-2-methyl-1-(phenylmethyl)-4-pyrrolo[3,2-c]pyridinyl]oxy]acetic acid IUPAC Name: 2-[3-(2-amino-2-oxoethyl)-1-benzyl-2-methylpyrrolo[3,2-c]pyridin-4-yl]oxyacetic acid Traditional Name: 2-[3-(2-amino-2-keto-ethyl)-1-benzyl-2-methyl-pyrrolo[3,2-c]pyridin-4-yl]oxyacetic acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CN=C2OCC(=O)O)CC(=O)N

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CN=C2OCC(=O)O)CC(=O)N

InChI

InChI=1S/C19H19N3O4/c1-12-14(9-16(20)23)18-15(7-8-21-19(18)26-11-17(24)25)22(12)10-13-5-3-2-4-6-13/h2-8H,9-11H2,1H3,(H2,20,23)(H,24,25)