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

Systemtic Name: 9-[[4-[4-(aminomethyl)-5-azanyl-pentyl]phenyl]amino]-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide Openeye Name: 9-[4-[5-amino-4-(aminomethyl)pentyl]anilino]-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide CAS Name: 9-[4-[5-amino-4-(aminomethyl)pentyl]anilino]-N-(2-dimethylaminoethyl)-5-methoxy-4-acridinecarboxamide IUPAC Name: 9-[4-[5-amino-4-(aminomethyl)pentyl]anilino]-N-(2-dimethylaminoethyl)-5-methoxyacridine-4-carboxamide Traditional Name: 9-[4-[5-amino-4-(aminomethyl)pentyl]anilino]-N-(2-dimethylaminoethyl)-5-methoxy-acridine-4-carboxamide Formula: C31H40N6O2 MolecularWeight: 528.6883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H40N6O2/c1-37(2)18-17-34-31(38)26-11-5-9-24-28(25-10-6-12-27(39-3)30(25)36-29(24)26)35-23-15-13-21(14-16-23)7-4-8-22(19-32)20-33/h5-6,9-16,22H,4,7-8,17-20,32-33H2,1-3H3,(H,34,38)(H,35,36)