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

Systemtic Name: 2-methoxyethyl 3-azanyl-4-[[3-[4-(2-phenylmethoxyethyl)piperazin-1-yl]phenyl]amino]benzoate Openeye Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-benzyloxyethyl)piperazin-1-yl]anilino]benzoate CAS Name: 3-amino-4-[3-[4-(2-phenylmethoxyethyl)-1-piperazinyl]anilino]benzoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-amino-4-[3-[4-(2-phenylmethoxyethyl)piperazin-1-yl]anilino]benzoate Traditional Name: 3-amino-4-[3-[4-(2-benzoxyethyl)piperazino]anilino]benzoic acid 2-methoxyethyl ester Formula: C29H36N4O4 MolecularWeight: 504.62054

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CCOCC4=CC=CC=C4)N

Isomeric SMILES

COCCOC(=O)C1=CC(=C(C=C1)NC2=CC=CC(=C2)N3CCN(CC3)CCOCC4=CC=CC=C4)N

InChI

InChI=1S/C29H36N4O4/c1-35-18-19-37-29(34)24-10-11-28(27(30)20-24)31-25-8-5-9-26(21-25)33-14-12-32(13-15-33)16-17-36-22-23-6-3-2-4-7-23/h2-11,20-21,31H,12-19,22,30H2,1H3