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4-[1-[[2-[(4-cyanophenyl)carbamoylamino]phenyl]amino]ethyl]benzoic acid

4-[1-[[2-[(4-cyanophenyl)carbamoylamino]phenyl]amino]ethyl]benzoic acid

Systemtic Name:4-[1-[[2-[(4-cyanophenyl)carbamoylamino]phenyl]amino]ethyl]benzoic acid
Openeye Name:4-[1-[2-[(4-cyanophenyl)carbamoylamino]anilino]ethyl]benzoic acid
CAS Name:4-[1-[2-[[(4-cyanoanilino)-oxomethyl]amino]anilino]ethyl]benzoic acid
IUPAC Name:4-[1-[2-[(4-cyanophenyl)carbamoylamino]anilino]ethyl]benzoic acid
Traditional Name:4-[1-[2-[(4-cyanophenyl)carbamoylamino]anilino]ethyl]benzoic acid
Formula: C23H20N4O3
MolecularWeight: 400.4299
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)O)NC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C#N


Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)O)NC2=CC=CC=C2NC(=O)NC3=CC=C(C=C3)C#N


InChI

InChI=1S/C23H20N4O3/c1-15(17-8-10-18(11-9-17)22(28)29)25-20-4-2-3-5-21(20)27-23(30)26-19-12-6-16(14-24)7-13-19/h2-13,15,25H,1H3,(H,28,29)(H2,26,27,30)


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