5-azanyl-4-[[4-(4-azanylbutylamino)quinolin-3-yl]carbonylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-4-[[4-(4-azanylbutylamino)quinolin-3-yl]carbonylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-4-[[4-(4-aminobutylamino)quinoline-3-carbonyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-4-[[[4-(4-aminobutylamino)-3-quinolinyl]-oxomethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-4-[[4-(4-aminobutylamino)quinoline-3-carbonyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-4-[[4-(4-aminobutylamino)quinoline-3-carbonyl]amino]-5-keto-valeric acid Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)NC(CCC(=O)O)C(=O)N)NCCCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=O)NC(CCC(=O)O)C(=O)N)NCCCCN

InChI

InChI=1S/C19H25N5O4/c20-9-3-4-10-22-17-12-5-1-2-6-14(12)23-11-13(17)19(28)24-15(18(21)27)7-8-16(25)26/h1-2,5-6,11,15H,3-4,7-10,20H2,(H2,21,27)(H,22,23)(H,24,28)(H,25,26)