5-[bis(azanyl)methylideneamino]-2-[(10-methylacridin-10-ium-1-yl)methylamino]pentanoic acid

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-[(10-methylacridin-10-ium-1-yl)methylamino]pentanoic acid Openeye Name: 5-guanidino-2-[(10-methylacridin-10-ium-1-yl)methylamino]pentanoic acid CAS Name: 5-(diaminomethylideneamino)-2-[(10-methyl-1-acridin-10-iumyl)methylamino]pentanoic acid IUPAC Name: 5-(diaminomethylideneamino)-2-[(10-methylacridin-10-ium-1-yl)methylamino]pentanoic acid Traditional Name: 5-guanidino-2-[(10-methylacridin-10-ium-1-yl)methylamino]valeric acid Formula: C21H26N5O2+ MolecularWeight: 380.46344

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=C(C2=CC3=CC=CC=C31)CNC(CCCN=C(N)N)C(=O)O

Isomeric SMILES

C[N+]1=C2C=CC=C(C2=CC3=CC=CC=C31)CNC(CCCN=C(N)N)C(=O)O

InChI

InChI=1S/C21H25N5O2/c1-26-18-9-3-2-6-14(18)12-16-15(7-4-10-19(16)26)13-25-17(20(27)28)8-5-11-24-21(22)23/h2-4,6-7,9-10,12,17,25H,5,8,11,13H2,1H3,(H4-,22,23,24,27,28)/p+1