1-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]-3-(3-methoxyphenoxy)propan-2-ol

Systemtic Name: 1-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]-3-(3-methoxyphenoxy)propan-2-ol Openeye Name: 1-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]-3-(3-methoxyphenoxy)propan-2-ol CAS Name: 1-[[1-(4,7-dimethyl-2-quinazolinyl)-4-azepanyl]amino]-3-(3-methoxyphenoxy)-2-propanol IUPAC Name: 1-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]-3-(3-methoxyphenoxy)propan-2-ol Traditional Name: 1-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]-3-(3-methoxyphenoxy)propan-2-ol Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCC(COC4=CC=CC(=C4)OC)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCC(COC4=CC=CC(=C4)OC)O)C

InChI

InChI=1S/C26H34N4O3/c1-18-9-10-24-19(2)28-26(29-25(24)14-18)30-12-5-6-20(11-13-30)27-16-21(31)17-33-23-8-4-7-22(15-23)32-3/h4,7-10,14-15,20-21,27,31H,5-6,11-13,16-17H2,1-3H3