1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-urea

Systemtic Name: 1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(6-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-phenyl-urea Openeye Name: 1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenyl-urea CAS Name: 1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylurea IUPAC Name: 1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-phenylurea Traditional Name: 1-[[(2S)-1,4-dioxan-2-yl]methyl]-1-[(2-keto-6-methyl-1H-quinolin-3-yl)methyl]-3-phenyl-urea Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(CC3COCCO3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)C(=C2)CN(C[C@H]3COCCO3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O4/c1-16-7-8-21-17(11-16)12-18(22(27)25-21)13-26(14-20-15-29-9-10-30-20)23(28)24-19-5-3-2-4-6-19/h2-8,11-12,20H,9-10,13-15H2,1H3,(H,24,28)(H,25,27)/t20-/m0/s1