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4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid

4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid

Systemtic Name:4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid
Openeye Name:4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid
CAS Name:4-[[[4-(9-acridinylamino)anilino]-oxomethyl]amino]benzoic acid
IUPAC Name:4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid
Traditional Name:4-[[4-(acridin-9-ylamino)phenyl]carbamoylamino]benzoic acid
Formula: C27H20N4O3
MolecularWeight: 448.4727
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NC(=O)NC5=CC=C(C=C5)C(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)NC(=O)NC5=CC=C(C=C5)C(=O)O


InChI

InChI=1S/C27H20N4O3/c32-26(33)17-9-11-19(12-10-17)29-27(34)30-20-15-13-18(14-16-20)28-25-21-5-1-3-7-23(21)31-24-8-4-2-6-22(24)25/h1-16H,(H,28,31)(H,32,33)(H2,29,30,34)


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