ethyl 5-(aminomethyl)-4-(2-ethoxy-2-oxidanylidene-ethyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-(aminomethyl)-4-(2-ethoxy-2-oxidanylidene-ethyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(aminomethyl)-4-(2-ethoxy-2-oxo-ethyl)-1H-pyrrole-3-carboxylate CAS Name: 5-(aminomethyl)-4-(2-ethoxy-2-oxoethyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(aminomethyl)-4-(2-ethoxy-2-oxoethyl)-1H-pyrrole-3-carboxylate Traditional Name: 5-(aminomethyl)-4-(2-ethoxy-2-keto-ethyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(NC=C1C(=O)OCC)CN

Isomeric SMILES

CCOC(=O)CC1=C(NC=C1C(=O)OCC)CN

InChI

InChI=1S/C12H18N2O4/c1-3-17-11(15)5-8-9(12(16)18-4-2)7-14-10(8)6-13/h7,14H,3-6,13H2,1-2H3