4-[bis(azanyl)methylideneamino]-N-[2-(3-carbamimidoylphenoxy)ethyl]benzamide

Systemtic Name: 4-[bis(azanyl)methylideneamino]-N-[2-(3-carbamimidoylphenoxy)ethyl]benzamide Openeye Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-4-guanidino-benzamide CAS Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(diaminomethylideneamino)benzamide IUPAC Name: N-[2-(3-carbamimidoylphenoxy)ethyl]-4-(diaminomethylideneamino)benzamide Traditional Name: N-[2-(3-amidinophenoxy)ethyl]-4-guanidino-benzamide Formula: C17H20N6O2 MolecularWeight: 340.3797

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCNC(=O)C2=CC=C(C=C2)N=C(N)N)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCNC(=O)C2=CC=C(C=C2)N=C(N)N)C(=N)N

InChI

InChI=1S/C17H20N6O2/c18-15(19)12-2-1-3-14(10-12)25-9-8-22-16(24)11-4-6-13(7-5-11)23-17(20)21/h1-7,10H,8-9H2,(H3,18,19)(H,22,24)(H4,20,21,23)