3-[butyl(phenyl)amino]-6-phenethyl-6-phenyl-oxane-2,4-dione

Systemtic Name: 3-[butyl(phenyl)amino]-6-phenethyl-6-phenyl-oxane-2,4-dione Openeye Name: 3-(N-butylanilino)-6-phenethyl-6-phenyl-tetrahydropyran-2,4-dione CAS Name: 3-(N-butylanilino)-6-phenethyl-6-phenyloxane-2,4-dione IUPAC Name: 3-(N-butylanilino)-6-phenethyl-6-phenyloxane-2,4-dione Traditional Name: 3-(N-butylanilino)-6-phenethyl-6-phenyl-tetrahydropyran-2,4-quinone Formula: C29H31NO3 MolecularWeight: 441.56134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1C(=O)CC(OC1=O)(CCC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN(C1C(=O)CC(OC1=O)(CCC2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31NO3/c1-2-3-21-30(25-17-11-6-12-18-25)27-26(31)22-29(33-28(27)32,24-15-9-5-10-16-24)20-19-23-13-7-4-8-14-23/h4-18,27H,2-3,19-22H2,1H3