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

Systemtic Name: 9-[[3-azanyl-5-(hydroxymethyl)phenyl]amino]-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide Openeye Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide CAS Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)-5-methoxy-4-acridinecarboxamide IUPAC Name: 9-[3-amino-5-(hydroxymethyl)anilino]-N-(2-dimethylaminoethyl)-5-methoxyacridine-4-carboxamide Traditional Name: 9-(3-amino-5-methylol-anilino)-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=O)C1=CC=CC2=C1N=C3C(=C2NC4=CC(=CC(=C4)N)CO)C=CC=C3OC

Isomeric SMILES

CN(C)CCNC(=O)C1=CC=CC2=C1N=C3C(=C2NC4=CC(=CC(=C4)N)CO)C=CC=C3OC

InChI

InChI=1S/C26H29N5O3/c1-31(2)11-10-28-26(33)21-8-4-6-19-23(29-18-13-16(15-32)12-17(27)14-18)20-7-5-9-22(34-3)25(20)30-24(19)21/h4-9,12-14,32H,10-11,15,27H2,1-3H3,(H,28,33)(H,29,30)