4-[(2-methoxyacridin-9-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol; phosphoric acid

Systemtic Name: 4-[(2-methoxyacridin-9-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol; phosphoric acid Openeye Name: 4-[(2-methoxyacridin-9-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol; phosphoric acid CAS Name: 4-[(2-methoxy-9-acridinyl)amino]-2,6-bis(1-pyrrolidinylmethyl)phenol; phosphoric acid IUPAC Name: 4-[(2-methoxyacridin-9-yl)amino]-2,6-bis(pyrrolidin-1-ylmethyl)phenol; phosphoric acid Traditional Name: 4-[(2-methoxyacridin-9-yl)amino]-2,6-bis(pyrrolidinomethyl)phenol; phosphoric acid Formula: C30H37N4O6P MolecularWeight: 580.611741

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C3=CC=CC=C3N=C2C=C1)NC4=CC(=C(C(=C4)CN5CCCC5)O)CN6CCCC6.OP(=O)(O)O

Isomeric SMILES

COC1=CC2=C(C3=CC=CC=C3N=C2C=C1)NC4=CC(=C(C(=C4)CN5CCCC5)O)CN6CCCC6.OP(=O)(O)O

InChI

InChI=1S/C30H34N4O2.H3O4P/c1-36-24-10-11-28-26(18-24)29(25-8-2-3-9-27(25)32-28)31-23-16-21(19-33-12-4-5-13-33)30(35)22(17-23)20-34-14-6-7-15-34;1-5(2,3)4/h2-3,8-11,16-18,35H,4-7,12-15,19-20H2,1H3,(H,31,32);(H3,1,2,3,4)