4-[2-(acridin-10-ium-9-ylamino)ethanoylamino]butanoate

Systemtic Name: 4-[2-(acridin-10-ium-9-ylamino)ethanoylamino]butanoate Openeye Name: 4-[[2-(acridin-10-ium-9-ylamino)acetyl]amino]butanoate CAS Name: 4-[[2-(9-acridin-10-iumylamino)-1-oxoethyl]amino]butanoate IUPAC Name: 4-[[2-(acridin-10-ium-9-ylamino)acetyl]amino]butanoate Traditional Name: 4-[[2-(acridin-10-ium-9-ylamino)acetyl]amino]butyrate Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NCC(=O)NCCCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[NH+]2)NCC(=O)NCCCC(=O)[O-]

InChI

InChI=1S/C19H19N3O3/c23-17(20-11-5-10-18(24)25)12-21-19-13-6-1-3-8-15(13)22-16-9-4-2-7-14(16)19/h1-4,6-9H,5,10-12H2,(H,20,23)(H,21,22)(H,24,25)