propan-2-yl 1-methyl-4-(quinolin-2-ylmethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate

Systemtic Name: propan-2-yl 1-methyl-4-(quinolin-2-ylmethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate Openeye Name: isopropyl 1-methyl-4-(2-quinolylmethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate CAS Name: 1-methyl-4-(2-quinolinylmethyl)-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-methyl-4-(quinolin-2-ylmethyl)pyrrolo[3,2-b]pyrrole-5-carboxylate Traditional Name: 1-methyl-4-(2-quinolylmethyl)pyrrolo[3,2-b]pyrrole-5-carboxylic acid isopropyl ester Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC2=C(N1CC3=NC4=CC=CC=C4C=C3)C=CN2C

Isomeric SMILES

CC(C)OC(=O)C1=CC2=C(N1CC3=NC4=CC=CC=C4C=C3)C=CN2C

InChI

InChI=1S/C21H21N3O2/c1-14(2)26-21(25)20-12-19-18(10-11-23(19)3)24(20)13-16-9-8-15-6-4-5-7-17(15)22-16/h4-12,14H,13H2,1-3H3