2-azanyl-2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid

Systemtic Name: 2-azanyl-2-[4-(4,9-diethoxy-3-oxidanylidene-1H-benzo[f]isoindol-2-yl)phenyl]ethanoic acid Openeye Name: 2-amino-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid CAS Name: 2-amino-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid IUPAC Name: 2-amino-2-[4-(4,9-diethoxy-3-oxo-1H-benzo[f]isoindol-2-yl)phenyl]acetic acid Traditional Name: 2-amino-2-[4-(4,9-diethoxy-3-keto-1H-benz[f]isoindol-2-yl)phenyl]acetic acid Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)C(C(=O)O)N

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=CC=CC=C31)OCC)C4=CC=C(C=C4)C(C(=O)O)N

InChI

InChI=1S/C24H24N2O5/c1-3-30-21-16-7-5-6-8-17(16)22(31-4-2)19-18(21)13-26(23(19)27)15-11-9-14(10-12-15)20(25)24(28)29/h5-12,20H,3-4,13,25H2,1-2H3,(H,28,29)