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

Systemtic Name: 2-methoxyethyl 3-azanyl-4-[[3-[4-(2-oxidanylidene-2-propoxy-ethyl)piperazin-1-yl]phenyl]amino]benzoate Openeye Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-oxo-2-propoxy-ethyl)piperazin-1-yl]anilino]benzoate CAS Name: 3-amino-4-[3-[4-(2-oxo-2-propoxyethyl)-1-piperazinyl]anilino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-oxo-2-propoxyethyl)piperazin-1-yl]anilino]benzoate Traditional Name: 3-amino-4-[3-[4-(2-keto-2-propoxy-ethyl)piperazino]anilino]benzoic acid 2-methoxyethyl ester Formula: C25H34N4O5 MolecularWeight: 470.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CN1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

Isomeric SMILES

CCCOC(=O)CN1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

InChI

InChI=1S/C25H34N4O5/c1-3-13-33-24(30)18-28-9-11-29(12-10-28)21-6-4-5-20(17-21)27-23-8-7-19(16-22(23)26)25(31)34-15-14-32-2/h4-8,16-17,27H,3,9-15,18,26H2,1-2H3