ethanedioic acid; 6-[3-(4-phenylpiperazin-1-yl)propanoyl]-1-prop-2-enyl-3,4-dihydroquinolin-2-one

Systemtic Name: ethanedioic acid; 6-[3-(4-phenylpiperazin-1-yl)propanoyl]-1-prop-2-enyl-3,4-dihydroquinolin-2-one Openeye Name: 1-allyl-6-[3-(4-phenylpiperazin-1-yl)propanoyl]-3,4-dihydroquinolin-2-one; oxalic acid CAS Name: oxalic acid; 6-[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]-1-prop-2-enyl-3,4-dihydroquinolin-2-one IUPAC Name: oxalic acid; 6-[3-(4-phenylpiperazin-1-yl)propanoyl]-1-prop-2-enyl-3,4-dihydroquinolin-2-one Traditional Name: 1-allyl-6-[3-(4-phenylpiperazino)propanoyl]-3,4-dihydrocarbostyril; oxalic acid Formula: C27H31N3O6 MolecularWeight: 493.55154

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)CCC2=C1C=CC(=C2)C(=O)CCN3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C=CCN1C(=O)CCC2=C1C=CC(=C2)C(=O)CCN3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H29N3O2.C2H2O4/c1-2-13-28-23-10-8-21(19-20(23)9-11-25(28)30)24(29)12-14-26-15-17-27(18-16-26)22-6-4-3-5-7-22;3-1(4)2(5)6/h2-8,10,19H,1,9,11-18H2;(H,3,4)(H,5,6)