(4-methoxycarbonylphenyl)methyl-[(2R)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: (4-methoxycarbonylphenyl)methyl-[(2R)-1-[(4-morpholin-4-ylphenyl)amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: (4-methoxycarbonylphenyl)methyl-[(1R)-1-methyl-2-(4-morpholinoanilino)-2-oxo-ethyl]ammonium CAS Name: (4-methoxycarbonylphenyl)methyl-[(2R)-1-[4-(4-morpholinyl)anilino]-1-oxopropan-2-yl]ammonium IUPAC Name: (4-methoxycarbonylphenyl)methyl-[(2R)-1-(4-morpholin-4-ylanilino)-1-oxopropan-2-yl]azanium Traditional Name: (4-carbomethoxybenzyl)-[(1R)-2-keto-1-methyl-2-(4-morpholinoanilino)ethyl]ammonium Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH2+]CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)N2CCOCC2)[NH2+]CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H27N3O4/c1-16(23-15-17-3-5-18(6-4-17)22(27)28-2)21(26)24-19-7-9-20(10-8-19)25-11-13-29-14-12-25/h3-10,16,23H,11-15H2,1-2H3,(H,24,26)/p+1/t16-/m1/s1