(2R)-2-[[(E)-but-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (2R)-2-[[(E)-but-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: (2R)-2-[[(E)-but-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-3-(1H-indol-3-yl)-2-[[(E)-1-oxobut-2-enyl]amino]propanoate IUPAC Name: (2R)-2-[[(E)-but-2-enoyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[(E)-but-2-enoyl]amino]-3-(1H-indol-3-yl)propionate Formula: C15H15N2O3- MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O3/c1-2-5-14(18)17-13(15(19)20)8-10-9-16-12-7-4-3-6-11(10)12/h2-7,9,13,16H,8H2,1H3,(H,17,18)(H,19,20)/p-1/b5-2+/t13-/m1/s1