methyl 4-[[(2S)-6-aminocarbonyl-2-(cyclohexylmethyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(2S)-6-aminocarbonyl-2-(cyclohexylmethyl)-3-oxidanylidene-2,4-dihydroquinoxalin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[(2S)-6-carbamoyl-2-(cyclohexylmethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoate CAS Name: 4-[[(2S)-6-carbamoyl-2-(cyclohexylmethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2S)-6-carbamoyl-2-(cyclohexylmethyl)-3-oxo-2,4-dihydroquinoxalin-1-yl]methyl]benzoate Traditional Name: 4-[[(2S)-6-carbamoyl-2-(cyclohexylmethyl)-3-keto-2,4-dihydroquinoxalin-1-yl]methyl]benzoic acid methyl ester Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C(C(=O)NC3=C2C=CC(=C3)C(=O)N)CC4CCCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2[C@H](C(=O)NC3=C2C=CC(=C3)C(=O)N)CC4CCCCC4

InChI

InChI=1S/C25H29N3O4/c1-32-25(31)18-9-7-17(8-10-18)15-28-21-12-11-19(23(26)29)14-20(21)27-24(30)22(28)13-16-5-3-2-4-6-16/h7-12,14,16,22H,2-6,13,15H2,1H3,(H2,26,29)(H,27,30)/t22-/m0/s1