N4-(4-chloranyl-5,8-dimethoxy-2-methyl-quinolin-6-yl)-N1,N1-diethyl-pentane-1,4-diamine; naphthalene-1,5-disulfonic acid

Systemtic Name: N4-(4-chloranyl-5,8-dimethoxy-2-methyl-quinolin-6-yl)-N1,N1-diethyl-pentane-1,4-diamine; naphthalene-1,5-disulfonic acid Openeye Name: N4-(4-chloro-5,8-dimethoxy-2-methyl-6-quinolyl)-N1,N1-diethyl-pentane-1,4-diamine; naphthalene-1,5-disulfonic acid CAS Name: N4-(4-chloro-5,8-dimethoxy-2-methyl-6-quinolinyl)-N1,N1-diethylpentane-1,4-diamine; naphthalene-1,5-disulfonic acid IUPAC Name: 4-N-(4-chloro-5,8-dimethoxy-2-methylquinolin-6-yl)-1-N,1-N-diethylpentane-1,4-diamine; naphthalene-1,5-disulfonic acid Traditional Name: 4-[(4-chloro-5,8-dimethoxy-2-methyl-6-quinolyl)amino]pentyl-diethyl-amine; naphthalene-1,5-disulfonic acid Formula: C31H40ClN3O8S2 MolecularWeight: 682.2476

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC1=CC(=C2C(=C1OC)C(=CC(=N2)C)Cl)OC.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O

Isomeric SMILES

CCN(CC)CCCC(C)NC1=CC(=C2C(=C1OC)C(=CC(=N2)C)Cl)OC.C1=CC2=C(C=CC=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O

InChI

InChI=1S/C21H32ClN3O2.C10H8O6S2/c1-7-25(8-2)11-9-10-14(3)23-17-13-18(26-5)20-19(21(17)27-6)16(22)12-15(4)24-20;11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16/h12-14,23H,7-11H2,1-6H3;1-6H,(H,11,12,13)(H,14,15,16)