methyl 4-[5-[3,4-bis(oxidanylidene)naphthalen-1-yl]oxypentanoylamino]-1-methyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[5-[3,4-bis(oxidanylidene)naphthalen-1-yl]oxypentanoylamino]-1-methyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[5-[(3,4-dioxo-1-naphthyl)oxy]pentanoylamino]-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[5-[(3,4-dioxo-1-naphthalenyl)oxy]-1-oxopentyl]amino]-1-methyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[5-(3,4-dioxonaphthalen-1-yl)oxypentanoylamino]-1-methylpyrrole-2-carboxylate Traditional Name: 4-[5-(3,4-diketo-1-naphthoxy)pentanoylamino]-1-methyl-pyrrole-2-carboxylic acid methyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)OC)NC(=O)CCCCOC2=CC(=O)C(=O)C3=CC=CC=C32

Isomeric SMILES

CN1C=C(C=C1C(=O)OC)NC(=O)CCCCOC2=CC(=O)C(=O)C3=CC=CC=C32

InChI

InChI=1S/C22H22N2O6/c1-24-13-14(11-17(24)22(28)29-2)23-20(26)9-5-6-10-30-19-12-18(25)21(27)16-8-4-3-7-15(16)19/h3-4,7-8,11-13H,5-6,9-10H2,1-2H3,(H,23,26)