propan-2-yl 4-(3-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-2-yl)benzoate

Systemtic Name: propan-2-yl 4-(3-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-2-yl)benzoate Openeye Name: isopropyl 4-(3-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-2-yl)benzoate CAS Name: 4-(3-methyl-7-phenacyl-2-pyrrolo[2,3-b]pyridinyl)benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(3-methyl-7-phenacylpyrrolo[2,3-b]pyridin-2-yl)benzoate Traditional Name: 4-(3-methyl-7-phenacyl-pyrrolo[2,3-b]pyridin-2-yl)benzoic acid isopropyl ester Formula: C26H24N2O3 MolecularWeight: 412.48036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C1=CC=CN2CC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(N=C2C1=CC=CN2CC(=O)C3=CC=CC=C3)C4=CC=C(C=C4)C(=O)OC(C)C

InChI

InChI=1S/C26H24N2O3/c1-17(2)31-26(30)21-13-11-20(12-14-21)24-18(3)22-10-7-15-28(25(22)27-24)16-23(29)19-8-5-4-6-9-19/h4-15,17H,16H2,1-3H3