3-[1-(3-aminophenyl)propyl]-6-oxidanyl-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one

Systemtic Name: 3-[1-(3-aminophenyl)propyl]-6-oxidanyl-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one Openeye Name: 3-[1-(3-aminophenyl)propyl]-6-hydroxy-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one CAS Name: 3-[1-(3-aminophenyl)propyl]-6-hydroxy-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one IUPAC Name: 3-[1-(3-aminophenyl)propyl]-6-hydroxy-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one Traditional Name: 3-[1-(3-aminophenyl)propyl]-6-hydroxy-5-(1-phenylethyl)-2-propyl-2,3-dihydropyran-4-one Formula: C25H31NO3 MolecularWeight: 393.51854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=O)C(=C(O1)O)C(C)C2=CC=CC=C2)C(CC)C3=CC(=CC=C3)N

Isomeric SMILES

CCCC1C(C(=O)C(=C(O1)O)C(C)C2=CC=CC=C2)C(CC)C3=CC(=CC=C3)N

InChI

InChI=1S/C25H31NO3/c1-4-10-21-23(20(5-2)18-13-9-14-19(26)15-18)24(27)22(25(28)29-21)16(3)17-11-7-6-8-12-17/h6-9,11-16,20-21,23,28H,4-5,10,26H2,1-3H3