7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-oxidanylidene-2,2-diphenyl-heptanenitrile; ethanedioic acid

Systemtic Name: 7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-oxidanylidene-2,2-diphenyl-heptanenitrile; ethanedioic acid Openeye Name: 7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-oxo-2,2-diphenyl-heptanenitrile; oxalic acid CAS Name: 7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-oxo-2,2-diphenylheptanenitrile; oxalic acid IUPAC Name: 7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-oxo-2,2-diphenylheptanenitrile; oxalic acid Traditional Name: 7-[3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]-7-keto-2,2-diphenyl-enanthonitrile; oxalic acid Formula: C33H37N3O5 MolecularWeight: 555.66398

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CC2=CC=CC=C2N(C1)C(=O)CCCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CN(C)CC1CC2=CC=CC=C2N(C1)C(=O)CCCCC(C#N)(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C31H35N3O.C2H2O4/c1-33(2)22-25-21-26-13-9-10-18-29(26)34(23-25)30(35)19-11-12-20-31(24-32,27-14-5-3-6-15-27)28-16-7-4-8-17-28;3-1(4)2(5)6/h3-10,13-18,25H,11-12,19-23H2,1-2H3;(H,3,4)(H,5,6)