O1-ethyl O2-methyl 3-azanyl-4-[(3-methylphenyl)methyl]pyrrole-1,2-dicarboxylate

Systemtic Name: O1-ethyl O2-methyl 3-azanyl-4-[(3-methylphenyl)methyl]pyrrole-1,2-dicarboxylate Openeye Name: O1-ethyl O2-methyl 3-amino-4-(m-tolylmethyl)pyrrole-1,2-dicarboxylate CAS Name: 3-amino-4-[(3-methylphenyl)methyl]pyrrole-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester IUPAC Name: 1-O-ethyl 2-O-methyl 3-amino-4-[(3-methylphenyl)methyl]pyrrole-1,2-dicarboxylate Traditional Name: 3-amino-4-(3-methylbenzyl)pyrrole-1,2-dicarboxylic acid O1-ethyl ester O2-methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=C(C(=C1C(=O)OC)N)CC2=CC=CC(=C2)C

Isomeric SMILES

CCOC(=O)N1C=C(C(=C1C(=O)OC)N)CC2=CC=CC(=C2)C

InChI

InChI=1S/C17H20N2O4/c1-4-23-17(21)19-10-13(14(18)15(19)16(20)22-3)9-12-7-5-6-11(2)8-12/h5-8,10H,4,9,18H2,1-3H3