methyl 3-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]propanoate

Systemtic Name: methyl 3-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]propanoate Openeye Name: methyl 3-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]propanoate CAS Name: 3-[[1-(4,7-dimethyl-2-quinazolinyl)-4-azepanyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]propanoate Traditional Name: 3-[[1-(4,7-dimethylquinazolin-2-yl)azepan-4-yl]amino]propionic acid methyl ester Formula: C20H28N4O2 MolecularWeight: 356.46192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC(=O)OC)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=NC(=N2)N3CCCC(CC3)NCCC(=O)OC)C

InChI

InChI=1S/C20H28N4O2/c1-14-6-7-17-15(2)22-20(23-18(17)13-14)24-11-4-5-16(9-12-24)21-10-8-19(25)26-3/h6-7,13,16,21H,4-5,8-12H2,1-3H3