3-[[3-(acridin-9-ylamino)-5-(hydroxymethyl)phenyl]amino]propanoic acid

Systemtic Name: 3-[[3-(acridin-9-ylamino)-5-(hydroxymethyl)phenyl]amino]propanoic acid Openeye Name: 3-[3-(acridin-9-ylamino)-5-(hydroxymethyl)anilino]propanoic acid CAS Name: 3-[3-(9-acridinylamino)-5-(hydroxymethyl)anilino]propanoic acid IUPAC Name: 3-[3-(acridin-9-ylamino)-5-(hydroxymethyl)anilino]propanoic acid Traditional Name: 3-[3-(acridin-9-ylamino)-5-methylol-anilino]propionic acid Formula: C23H21N3O3 MolecularWeight: 387.43114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC(=CC(=C4)CO)NCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC(=CC(=C4)CO)NCCC(=O)O

InChI

InChI=1S/C23H21N3O3/c27-14-15-11-16(24-10-9-22(28)29)13-17(12-15)25-23-18-5-1-3-7-20(18)26-21-8-4-2-6-19(21)23/h1-8,11-13,24,27H,9-10,14H2,(H,25,26)(H,28,29)