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

Systemtic Name: 2-methoxyethyl 3-azanyl-4-[[3-(4-ethanoylpiperazin-1-yl)phenyl]amino]benzoate Openeye Name: 2-methoxyethyl 4-[3-(4-acetylpiperazin-1-yl)anilino]-3-amino-benzoate CAS Name: 4-[3-(4-acetyl-1-piperazinyl)anilino]-3-aminobenzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[3-(4-acetylpiperazin-1-yl)anilino]-3-aminobenzoate Traditional Name: 4-[3-(4-acetylpiperazino)anilino]-3-amino-benzoic acid 2-methoxyethyl ester Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OCCOC)N

InChI

InChI=1S/C22H28N4O4/c1-16(27)25-8-10-26(11-9-25)19-5-3-4-18(15-19)24-21-7-6-17(14-20(21)23)22(28)30-13-12-29-2/h3-7,14-15,24H,8-13,23H2,1-2H3