2-oxidanylidene-3-[(3-pentylphenyl)methyl]-5,6-diphenyl-morpholine-4-carboxylate

Systemtic Name: 2-oxidanylidene-3-[(3-pentylphenyl)methyl]-5,6-diphenyl-morpholine-4-carboxylate Openeye Name: 2-oxo-3-[(3-pentylphenyl)methyl]-5,6-diphenyl-morpholine-4-carboxylate CAS Name: 2-oxo-3-[(3-pentylphenyl)methyl]-5,6-diphenyl-4-morpholinecarboxylate IUPAC Name: 2-oxo-3-[(3-pentylphenyl)methyl]-5,6-diphenylmorpholine-4-carboxylate Traditional Name: 3-(3-amylbenzyl)-2-keto-5,6-diphenyl-morpholine-4-carboxylate Formula: C29H30NO4- MolecularWeight: 456.5528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=CC(=C1)CC2C(=O)OC(C(N2C(=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCC1=CC=CC(=C1)CC2C(=O)OC(C(N2C(=O)[O-])C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31NO4/c1-2-3-6-12-21-13-11-14-22(19-21)20-25-28(31)34-27(24-17-9-5-10-18-24)26(30(25)29(32)33)23-15-7-4-8-16-23/h4-5,7-11,13-19,25-27H,2-3,6,12,20H2,1H3,(H,32,33)/p-1