methyl 4-[[(4S)-4-azanyl-5-methoxy-5-oxidanylidene-pentyl]carbamoyl]benzoate

Systemtic Name: methyl 4-[[(4S)-4-azanyl-5-methoxy-5-oxidanylidene-pentyl]carbamoyl]benzoate Openeye Name: methyl 4-[[(4S)-4-amino-5-methoxy-5-oxo-pentyl]carbamoyl]benzoate CAS Name: 4-[[[(4S)-4-amino-5-methoxy-5-oxopentyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(4S)-4-amino-5-methoxy-5-oxopentyl]carbamoyl]benzoate Traditional Name: 4-[[(4S)-4-amino-5-keto-5-methoxy-pentyl]carbamoyl]benzoic acid methyl ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)NCCCC(C(=O)OC)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NCCC[C@@H](C(=O)OC)N

InChI

InChI=1S/C15H20N2O5/c1-21-14(19)11-7-5-10(6-8-11)13(18)17-9-3-4-12(16)15(20)22-2/h5-8,12H,3-4,9,16H2,1-2H3,(H,17,18)/t12-/m0/s1