diethyl 4-azanyl-5-(phenylmethyl)-2,5-dihydropyrrole-1,3-dicarboxylate

Systemtic Name: diethyl 4-azanyl-5-(phenylmethyl)-2,5-dihydropyrrole-1,3-dicarboxylate Openeye Name: diethyl 4-amino-5-benzyl-2,5-dihydropyrrole-1,3-dicarboxylate CAS Name: 4-amino-5-(phenylmethyl)-2,5-dihydropyrrole-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-amino-5-benzyl-2,5-dihydropyrrole-1,3-dicarboxylate Traditional Name: 4-amino-5-benzyl-3-pyrroline-1,3-dicarboxylic acid diethyl ester Formula: C17H22N2O4 MolecularWeight: 318.36758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(N(C1)C(=O)OCC)CC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=C(C(N(C1)C(=O)OCC)CC2=CC=CC=C2)N

InChI

InChI=1S/C17H22N2O4/c1-3-22-16(20)13-11-19(17(21)23-4-2)14(15(13)18)10-12-8-6-5-7-9-12/h5-9,14H,3-4,10-11,18H2,1-2H3