ethyl 3-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]-4-(4-ethylpiperazin-1-yl)benzoate

Systemtic Name: ethyl 3-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]-4-(4-ethylpiperazin-1-yl)benzoate Openeye Name: ethyl 3-[(5-chloro-2-methoxy-benzoyl)amino]-4-(4-ethylpiperazin-1-yl)benzoate CAS Name: 3-[[(5-chloro-2-methoxyphenyl)-oxomethyl]amino]-4-(4-ethyl-1-piperazinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[(5-chloro-2-methoxybenzoyl)amino]-4-(4-ethylpiperazin-1-yl)benzoate Traditional Name: 3-[(5-chloro-2-methoxy-benzoyl)amino]-4-(4-ethylpiperazino)benzoic acid ethyl ester Formula: C23H28ClN3O4 MolecularWeight: 445.93912

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C23H28ClN3O4/c1-4-26-10-12-27(13-11-26)20-8-6-16(23(29)31-5-2)14-19(20)25-22(28)18-15-17(24)7-9-21(18)30-3/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,25,28)