2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methyl-quinoline-4-carboxylate

Systemtic Name: 2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methyl-quinoline-4-carboxylate Openeye Name: 2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methyl-quinoline-4-carboxylate CAS Name: 2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methyl-4-quinolinecarboxylate IUPAC Name: 2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methylquinoline-4-carboxylate Traditional Name: 2-[3-methoxy-4-(3-phenylpropoxy)phenyl]-6-methyl-cinchoninate Formula: C27H24NO4- MolecularWeight: 426.48376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC(=C(C=C3)OCCCC4=CC=CC=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)[O-])C3=CC(=C(C=C3)OCCCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H25NO4/c1-18-10-12-23-21(15-18)22(27(29)30)17-24(28-23)20-11-13-25(26(16-20)31-2)32-14-6-9-19-7-4-3-5-8-19/h3-5,7-8,10-13,15-17H,6,9,14H2,1-2H3,(H,29,30)/p-1