tert-butyl 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]amino]propanoate

Systemtic Name: tert-butyl 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]amino]propanoate Openeye Name: tert-butyl 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-methoxy-3-oxo-prop-1-enyl]amino]propanoate CAS Name: 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-methoxy-3-oxoprop-1-enyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-methoxy-3-oxoprop-1-enyl]amino]propanoate Traditional Name: 3-[2-(1H-indol-3-yl)ethyl-[(E)-3-keto-3-methoxy-prop-1-enyl]amino]propionic acid tert-butyl ester Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCN(CCC1=CNC2=CC=CC=C21)C=CC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCN(CCC1=CNC2=CC=CC=C21)/C=C/C(=O)OC

InChI

InChI=1S/C21H28N2O4/c1-21(2,3)27-20(25)11-14-23(13-10-19(24)26-4)12-9-16-15-22-18-8-6-5-7-17(16)18/h5-8,10,13,15,22H,9,11-12,14H2,1-4H3/b13-10+