2-(1-oxidanylidene-3-phenethyloxy-isochromen-7-yl)guanidine

Systemtic Name: 2-(1-oxidanylidene-3-phenethyloxy-isochromen-7-yl)guanidine Openeye Name: 2-(1-oxo-3-phenethyloxy-isochromen-7-yl)guanidine CAS Name: 2-(1-oxo-3-phenethyloxy-2-benzopyran-7-yl)guanidine IUPAC Name: 2-(1-oxo-3-phenethyloxyisochromen-7-yl)guanidine Traditional Name: 2-(1-keto-3-phenethyloxy-isochromen-7-yl)guanidine Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=CC3=C(C=C(C=C3)N=C(N)N)C(=O)O2

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=CC3=C(C=C(C=C3)N=C(N)N)C(=O)O2

InChI

InChI=1S/C18H17N3O3/c19-18(20)21-14-7-6-13-10-16(24-17(22)15(13)11-14)23-9-8-12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H4,19,20,21)