(2S)-N-cyclododecyl-2-[2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-oxidanyl-propanamide

Systemtic Name: (2S)-N-cyclododecyl-2-[2-(7-methoxy-2-oxidanylidene-chromen-4-yl)ethanoylamino]-3-oxidanyl-propanamide Openeye Name: (2S)-N-cyclododecyl-3-hydroxy-2-[[2-(7-methoxy-2-oxo-chromen-4-yl)acetyl]amino]propanamide CAS Name: (2S)-N-cyclododecyl-3-hydroxy-2-[[2-(7-methoxy-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]propanamide IUPAC Name: (2S)-N-cyclododecyl-3-hydroxy-2-[[2-(7-methoxy-2-oxochromen-4-yl)acetyl]amino]propanamide Traditional Name: (2S)-N-cyclododecyl-3-hydroxy-2-[[2-(2-keto-7-methoxy-chromen-4-yl)acetyl]amino]propionamide Formula: C27H38N2O6 MolecularWeight: 486.60042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC(CO)C(=O)NC3CCCCCCCCCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)N[C@@H](CO)C(=O)NC3CCCCCCCCCCC3

InChI

InChI=1S/C27H38N2O6/c1-34-21-13-14-22-19(16-26(32)35-24(22)17-21)15-25(31)29-23(18-30)27(33)28-20-11-9-7-5-3-2-4-6-8-10-12-20/h13-14,16-17,20,23,30H,2-12,15,18H2,1H3,(H,28,33)(H,29,31)/t23-/m0/s1