[2-[(3-butyl-4-oxidanylidene-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[(3-butyl-4-oxidanylidene-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(3-butyl-4-oxo-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(3-butyl-4-oxo-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenylphenyl] ester IUPAC Name: [2-[(3-butyl-4-oxo-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(3-butyl-4-keto-5,6,7,8-tetrahydroquinolin-1-yl)methyl]-6-phenyl-phenyl] ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN(C2=C(C1=O)CCCC2)CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CN(C2=C(C1=O)CCCC2)CC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO4/c1-2-3-10-20-17-28(24-16-8-7-14-23(24)25(20)29)18-21-13-9-15-22(26(21)32-27(30)31)19-11-5-4-6-12-19/h4-6,9,11-13,15,17H,2-3,7-8,10,14,16,18H2,1H3,(H,30,31)