tert-butyl 3-(2-azanylethyl)-2-[(E)-3-oxidanylprop-1-enyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-(2-azanylethyl)-2-[(E)-3-oxidanylprop-1-enyl]indole-1-carboxylate Openeye Name: tert-butyl 3-(2-aminoethyl)-2-[(E)-3-hydroxyprop-1-enyl]indole-1-carboxylate CAS Name: 3-(2-aminoethyl)-2-[(E)-3-hydroxyprop-1-enyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-aminoethyl)-2-[(E)-3-hydroxyprop-1-enyl]indole-1-carboxylate Traditional Name: 3-(2-aminoethyl)-2-[(E)-3-hydroxyprop-1-enyl]indole-1-carboxylic acid tert-butyl ester Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C2=CC=CC=C2C(=C1C=CCO)CCN

Isomeric SMILES

CC(C)(C)OC(=O)N1C2=CC=CC=C2C(=C1/C=C/CO)CCN

InChI

InChI=1S/C18H24N2O3/c1-18(2,3)23-17(22)20-15-8-5-4-7-13(15)14(10-11-19)16(20)9-6-12-21/h4-9,21H,10-12,19H2,1-3H3/b9-6+