dimethyl 3-[4-(4-methylpentanoylamino)phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate

Systemtic Name: dimethyl 3-[4-(4-methylpentanoylamino)phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate Openeye Name: dimethyl 3-[4-(4-methylpentanoylamino)phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate CAS Name: 3-[4-[(4-methyl-1-oxopentyl)amino]phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[4-(4-methylpentanoylamino)phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylate Traditional Name: 3-[4-(4-methylpentanoylamino)phenyl]-6,7-dihydro-5H-pyrrolizine-1,2-dicarboxylic acid dimethyl ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=CC=C(C=C1)C2=C(C(=C3N2CCC3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)CCC(=O)NC1=CC=C(C=C1)C2=C(C(=C3N2CCC3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C23H28N2O5/c1-14(2)7-12-18(26)24-16-10-8-15(9-11-16)21-20(23(28)30-4)19(22(27)29-3)17-6-5-13-25(17)21/h8-11,14H,5-7,12-13H2,1-4H3,(H,24,26)