2-methoxyethyl 3-azanyl-4-[[3-[4-(2-oxidanylideneoxolan-3-yl)piperazin-1-yl]phenyl]amino]benzoate

Systemtic Name: 2-methoxyethyl 3-azanyl-4-[[3-[4-(2-oxidanylideneoxolan-3-yl)piperazin-1-yl]phenyl]amino]benzoate Openeye Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-oxotetrahydrofuran-3-yl)piperazin-1-yl]anilino]benzoate CAS Name: 3-amino-4-[3-[4-(2-oxo-3-oxolanyl)-1-piperazinyl]anilino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-oxooxolan-3-yl)piperazin-1-yl]anilino]benzoate Traditional Name: 3-amino-4-[3-[4-(2-ketotetrahydrofuran-3-yl)piperazino]anilino]benzoic acid 2-methoxyethyl ester Formula: C24H30N4O5 MolecularWeight: 454.5188

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)C4CCOC4=O)N

Isomeric SMILES

COCCOC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)C4CCOC4=O)N

InChI

InChI=1S/C24H30N4O5/c1-31-13-14-33-23(29)17-5-6-21(20(25)15-17)26-18-3-2-4-19(16-18)27-8-10-28(11-9-27)22-7-12-32-24(22)30/h2-6,15-16,22,26H,7-14,25H2,1H3