dodecyl 3-methyl-2-[methyl-[4-oxidanylidene-2-(phenylmethoxycarbonylamino)oxetan-2-yl]carbamoyl]butanoate

Systemtic Name: dodecyl 3-methyl-2-[methyl-[4-oxidanylidene-2-(phenylmethoxycarbonylamino)oxetan-2-yl]carbamoyl]butanoate Openeye Name: dodecyl 2-[[2-(benzyloxycarbonylamino)-4-oxo-oxetan-2-yl]-methyl-carbamoyl]-3-methyl-butanoate CAS Name: 3-methyl-2-[[methyl-[4-oxo-2-(phenylmethoxycarbonylamino)-2-oxetanyl]amino]-oxomethyl]butanoic acid dodecyl ester IUPAC Name: dodecyl 3-methyl-2-[methyl-[4-oxo-2-(phenylmethoxycarbonylamino)oxetan-2-yl]carbamoyl]butanoate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-4-keto-oxetan-2-yl]-methyl-carbamoyl]-3-methyl-butyric acid lauryl ester Formula: C30H46N2O7 MolecularWeight: 546.69544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(C(C)C)C(=O)N(C)C1(CC(=O)O1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(C(C)C)C(=O)N(C)C1(CC(=O)O1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C30H46N2O7/c1-5-6-7-8-9-10-11-12-13-17-20-37-28(35)26(23(2)3)27(34)32(4)30(21-25(33)39-30)31-29(36)38-22-24-18-15-14-16-19-24/h14-16,18-19,23,26H,5-13,17,20-22H2,1-4H3,(H,31,36)