methyl 3-[[3-[(2R)-2-azanyl-3-oxidanylidene-propyl]-1H-indol-5-yl]oxymethyl]benzoate

Systemtic Name: methyl 3-[[3-[(2R)-2-azanyl-3-oxidanylidene-propyl]-1H-indol-5-yl]oxymethyl]benzoate Openeye Name: methyl 3-[[3-[(2R)-2-amino-3-oxo-propyl]-1H-indol-5-yl]oxymethyl]benzoate CAS Name: 3-[[3-[(2R)-2-amino-3-oxopropyl]-1H-indol-5-yl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[3-[(2R)-2-amino-3-oxopropyl]-1H-indol-5-yl]oxymethyl]benzoate Traditional Name: 3-[[3-[(2R)-2-amino-3-keto-propyl]-1H-indol-5-yl]oxymethyl]benzoic acid methyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC2=CC3=C(C=C2)NC=C3CC(C=O)N

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC2=CC3=C(C=C2)NC=C3C[C@H](C=O)N

InChI

InChI=1S/C20H20N2O4/c1-25-20(24)14-4-2-3-13(7-14)12-26-17-5-6-19-18(9-17)15(10-22-19)8-16(21)11-23/h2-7,9-11,16,22H,8,12,21H2,1H3/t16-/m1/s1