9-[[3-azanyl-5-(hydroxymethyl)phenyl]amino]-N-(2-dimethylaminoethyl)acridine-4-carboxamide

Systemtic Name: 9-[[3-azanyl-5-(hydroxymethyl)phenyl]amino]-N-(2-dimethylaminoethyl)acridine-4-carboxamide Openeye Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)acridine-4-carboxamide CAS Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)-4-acridinecarboxamide IUPAC Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)acridine-4-carboxamide Traditional Name: 9-(3-amino-5-methylol-anilino)-N-(2-dimethylaminoethyl)acridine-4-carboxamide Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=CC(=CC(=C4)N)CO

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=CC2=C(C3=CC=CC=C3N=C21)NC4=CC(=CC(=C4)N)CO

InChI

InChI=1S/C25H27N5O2/c1-30(2)11-10-27-25(32)21-8-5-7-20-23(19-6-3-4-9-22(19)29-24(20)21)28-18-13-16(15-31)12-17(26)14-18/h3-9,12-14,31H,10-11,15,26H2,1-2H3,(H,27,32)(H,28,29)