methyl 4-methyl-2-[3-(phenylcarbamoylamino)propanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: methyl 4-methyl-2-[3-(phenylcarbamoylamino)propanoyloxymethyl]quinoline-3-carboxylate Openeye Name: methyl 4-methyl-2-[3-(phenylcarbamoylamino)propanoyloxymethyl]quinoline-3-carboxylate CAS Name: 2-[[3-[[anilino(oxo)methyl]amino]-1-oxopropoxy]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[3-(phenylcarbamoylamino)propanoyloxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[3-(phenylcarbamoylamino)propanoyloxymethyl]quinoline-3-carboxylic acid methyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCNC(=O)NC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)CCNC(=O)NC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C23H23N3O5/c1-15-17-10-6-7-11-18(17)26-19(21(15)22(28)30-2)14-31-20(27)12-13-24-23(29)25-16-8-4-3-5-9-16/h3-11H,12-14H2,1-2H3,(H2,24,25,29)