N,N'-bis(4-azanyl-2-methyl-quinolin-6-yl)-2,2-bis(prop-2-enyl)propanediamide; ethanoic acid

Systemtic Name: N,N'-bis(4-azanyl-2-methyl-quinolin-6-yl)-2,2-bis(prop-2-enyl)propanediamide; ethanoic acid Openeye Name: acetic acid; 2,2-diallyl-N,N'-bis(4-amino-2-methyl-6-quinolyl)propanediamide CAS Name: acetic acid; N,N'-bis(4-amino-2-methyl-6-quinolinyl)-2,2-bis(prop-2-enyl)propanediamide IUPAC Name: acetic acid; N,N'-bis(4-amino-2-methylquinolin-6-yl)-2,2-bis(prop-2-enyl)propanediamide Traditional Name: acetic acid; 2,2-diallyl-N,N'-bis(4-amino-2-methyl-6-quinolyl)malonamide Formula: C31H34N6O4 MolecularWeight: 554.63946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C(CC=C)(CC=C)C(=O)NC3=CC4=C(C=C3)N=C(C=C4N)C)C(=C1)N.CC(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C(CC=C)(CC=C)C(=O)NC3=CC4=C(C=C3)N=C(C=C4N)C)C(=C1)N.CC(=O)O

InChI

InChI=1S/C29H30N6O2.C2H4O2/c1-5-11-29(12-6-2,27(36)34-19-7-9-25-21(15-19)23(30)13-17(3)32-25)28(37)35-20-8-10-26-22(16-20)24(31)14-18(4)33-26;1-2(3)4/h5-10,13-16H,1-2,11-12H2,3-4H3,(H2,30,32)(H2,31,33)(H,34,36)(H,35,37);1H3,(H,3,4)