3-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-4-methyl-pent-3-enoic acid

Systemtic Name: 3-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxidanylidene-propan-2-yl]carbamoyl]-4-methyl-pent-3-enoic acid Openeye Name: 3-[[(1S)-1-(1H-indol-3-ylmethyl)-2-methoxy-2-oxo-ethyl]carbamoyl]-4-methyl-pent-3-enoic acid CAS Name: 3-[[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]amino]-oxomethyl]-4-methyl-3-pentenoic acid IUPAC Name: 3-[[(2S)-3-(1H-indol-3-yl)-1-methoxy-1-oxopropan-2-yl]carbamoyl]-4-methylpent-3-enoic acid Traditional Name: 3-[[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-methoxy-ethyl]carbamoyl]-4-methyl-pent-3-enoic acid Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC(=O)O)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)C

Isomeric SMILES

CC(=C(CC(=O)O)C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OC)C

InChI

InChI=1S/C19H22N2O5/c1-11(2)14(9-17(22)23)18(24)21-16(19(25)26-3)8-12-10-20-15-7-5-4-6-13(12)15/h4-7,10,16,20H,8-9H2,1-3H3,(H,21,24)(H,22,23)/t16-/m0/s1