N-[5-[2-[[(2S)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methylamino]-2-oxidanylidene-ethyl]-1,2-oxazol-3-yl]propanamide; methanoic acid

Systemtic Name: N-[5-[2-[[(2S)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methylamino]-2-oxidanylidene-ethyl]-1,2-oxazol-3-yl]propanamide; methanoic acid Openeye Name: N-[5-[2-[[(2S)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methylamino]-2-oxo-ethyl]isoxazol-3-yl]propanamide; formic acid CAS Name: N-[5-[2-[[(2S)-4-[(3,4-dichlorophenyl)methyl]-2-morpholinyl]methylamino]-2-oxoethyl]-3-isoxazolyl]propanamide; formic acid IUPAC Name: N-[5-[2-[[(2S)-4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methylamino]-2-oxoethyl]-1,2-oxazol-3-yl]propanamide; formic acid Traditional Name: N-[5-[2-[[(2S)-4-(3,4-dichlorobenzyl)morpholin-2-yl]methylamino]-2-keto-ethyl]isoxazol-3-yl]propionamide; formic acid Formula: C21H26Cl2N4O6 MolecularWeight: 501.36034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NOC(=C1)CC(=O)NCC2CN(CCO2)CC3=CC(=C(C=C3)Cl)Cl.C(=O)O

Isomeric SMILES

CCC(=O)NC1=NOC(=C1)CC(=O)NC[C@H]2CN(CCO2)CC3=CC(=C(C=C3)Cl)Cl.C(=O)O

InChI

InChI=1S/C20H24Cl2N4O4.CH2O2/c1-2-19(27)24-18-8-14(30-25-18)9-20(28)23-10-15-12-26(5-6-29-15)11-13-3-4-16(21)17(22)7-13;2-1-3/h3-4,7-8,15H,2,5-6,9-12H2,1H3,(H,23,28)(H,24,25,27);1H,(H,2,3)/t15-;/m0./s1