ethyl 2-(ethynylamino)-3-(3-hexoxyindol-1-yl)propanoate

Systemtic Name: ethyl 2-(ethynylamino)-3-(3-hexoxyindol-1-yl)propanoate Openeye Name: ethyl 2-(ethynylamino)-3-(3-hexoxyindol-1-yl)propanoate CAS Name: 2-(ethynylamino)-3-(3-hexoxy-1-indolyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-(ethynylamino)-3-(3-hexoxyindol-1-yl)propanoate Traditional Name: 2-(ethynylamino)-3-(3-hexoxyindol-1-yl)propionic acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CN(C2=CC=CC=C21)CC(C(=O)OCC)NC#C

Isomeric SMILES

CCCCCCOC1=CN(C2=CC=CC=C21)CC(C(=O)OCC)NC#C

InChI

InChI=1S/C21H28N2O3/c1-4-7-8-11-14-26-20-16-23(19-13-10-9-12-17(19)20)15-18(22-5-2)21(24)25-6-3/h2,9-10,12-13,16,18,22H,4,6-8,11,14-15H2,1,3H3