5-[ethyl(2-hydroxyethyl)amino]-2-(quinolin-4-ylamino)pentanoic acid

Systemtic Name: 5-[ethyl(2-hydroxyethyl)amino]-2-(quinolin-4-ylamino)pentanoic acid Openeye Name: 5-[ethyl(2-hydroxyethyl)amino]-2-(4-quinolylamino)pentanoic acid CAS Name: 5-[ethyl(2-hydroxyethyl)amino]-2-(4-quinolinylamino)pentanoic acid IUPAC Name: 5-[ethyl(2-hydroxyethyl)amino]-2-(quinolin-4-ylamino)pentanoic acid Traditional Name: 5-[ethyl(2-hydroxyethyl)amino]-2-(4-quinolylamino)valeric acid Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(C(=O)O)NC1=CC=NC2=CC=CC=C21)CCO

Isomeric SMILES

CCN(CCCC(C(=O)O)NC1=CC=NC2=CC=CC=C21)CCO

InChI

InChI=1S/C18H25N3O3/c1-2-21(12-13-22)11-5-8-17(18(23)24)20-16-9-10-19-15-7-4-3-6-14(15)16/h3-4,6-7,9-10,17,22H,2,5,8,11-13H2,1H3,(H,19,20)(H,23,24)