tert-butyl 2-[(E)-methoxyiminomethyl]-3-methyl-4-pyridin-4-yl-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 2-[(E)-methoxyiminomethyl]-3-methyl-4-pyridin-4-yl-pyrrole-1-carboxylate Openeye Name: tert-butyl 2-[(E)-methoxyiminomethyl]-3-methyl-4-(4-pyridyl)pyrrole-1-carboxylate CAS Name: 2-[(E)-methoxyiminomethyl]-3-methyl-4-pyridin-4-yl-1-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(E)-methoxyiminomethyl]-3-methyl-4-pyridin-4-ylpyrrole-1-carboxylate Traditional Name: 3-methyl-2-[(E)-methyloximinomethyl]-4-(4-pyridyl)pyrrole-1-carboxylic acid tert-butyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C=C1C2=CC=NC=C2)C(=O)OC(C)(C)C)C=NOC

Isomeric SMILES

CC1=C(N(C=C1C2=CC=NC=C2)C(=O)OC(C)(C)C)/C=N/OC

InChI

InChI=1S/C17H21N3O3/c1-12-14(13-6-8-18-9-7-13)11-20(15(12)10-19-22-5)16(21)23-17(2,3)4/h6-11H,1-5H3/b19-10+