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

Systemtic Name: 2-hydroxyethyl 3-azanyl-4-[[3-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]amino]benzoate Openeye Name: 2-hydroxyethyl 3-amino-4-[3-[4-(2-hydroxyethyl)piperazin-1-yl]anilino]benzoate CAS Name: 3-amino-4-[3-[4-(2-hydroxyethyl)-1-piperazinyl]anilino]benzoic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 3-amino-4-[3-[4-(2-hydroxyethyl)piperazin-1-yl]anilino]benzoate Traditional Name: 3-amino-4-[3-[4-(2-hydroxyethyl)piperazino]anilino]benzoic acid 2-hydroxyethyl ester Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCO)N

Isomeric SMILES

C1CN(CCN1CCO)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCO)N

InChI

InChI=1S/C21H28N4O4/c22-19-14-16(21(28)29-13-12-27)4-5-20(19)23-17-2-1-3-18(15-17)25-8-6-24(7-9-25)10-11-26/h1-5,14-15,23,26-27H,6-13,22H2