ethyl N-[5-[(E)-diazanylidenemethyl]-1H-indol-3-yl]carbamate hydrate hydrochloride

Systemtic Name: ethyl N-[5-[(E)-diazanylidenemethyl]-1H-indol-3-yl]carbamate hydrate hydrochloride Openeye Name: ethyl N-[5-[(E)-hydrazinylidenemethyl]-1H-indol-3-yl]carbamate hydrate hydrochloride CAS Name: N-[5-[(E)-hydrazinylidenemethyl]-1H-indol-3-yl]carbamic acid ethyl ester hydrate hydrochloride IUPAC Name: ethyl N-[5-[(E)-hydrazinylidenemethyl]-1H-indol-3-yl]carbamate hydrate hydrochloride Traditional Name: N-[5-[(E)-hydrazonomethyl]-1H-indol-3-yl]carbamic acid ethyl ester hydrate hydrochloride Formula: C12H17ClN4O3 MolecularWeight: 300.74138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CNC2=C1C=C(C=C2)C=NN.O.Cl

Isomeric SMILES

CCOC(=O)NC1=CNC2=C1C=C(C=C2)/C=N/N.O.Cl

InChI

InChI=1S/C12H14N4O2.ClH.H2O/c1-2-18-12(17)16-11-7-14-10-4-3-8(6-15-13)5-9(10)11;;/h3-7,14H,2,13H2,1H3,(H,16,17);1H;1H2/b15-6+;;