10-[4-(acridin-9-ylamino)phenyl]decanoic acid hydrate hydrochloride

Systemtic Name: 10-[4-(acridin-9-ylamino)phenyl]decanoic acid hydrate hydrochloride Openeye Name: 10-[4-(acridin-9-ylamino)phenyl]decanoic acid hydrate hydrochloride CAS Name: 10-[4-(9-acridinylamino)phenyl]decanoic acid hydrate hydrochloride IUPAC Name: 10-[4-(acridin-9-ylamino)phenyl]decanoic acid hydrate hydrochloride Traditional Name: 10-[4-(acridin-9-ylamino)phenyl]capric acid hydrate hydrochloride Formula: C29H35ClN2O3 MolecularWeight: 495.0528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CCCCCCCCCC(=O)O.O.Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)CCCCCCCCCC(=O)O.O.Cl

InChI

InChI=1S/C29H32N2O2.ClH.H2O/c32-28(33)17-7-5-3-1-2-4-6-12-22-18-20-23(21-19-22)30-29-24-13-8-10-15-26(24)31-27-16-11-9-14-25(27)29;;/h8-11,13-16,18-21H,1-7,12,17H2,(H,30,31)(H,32,33);1H;1H2