(2R)-2-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-quinolin-5-yl-propanamide

Systemtic Name: (2R)-2-[4-[2-(ethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-N-quinolin-5-yl-propanamide Openeye Name: (2R)-2-[4-[2-(ethylamino)-2-oxo-ethyl]piperazin-4-ium-1-yl]-N-(5-quinolyl)propanamide CAS Name: (2R)-2-[4-[2-(ethylamino)-2-oxoethyl]-1-piperazin-4-iumyl]-N-(5-quinolinyl)propanamide IUPAC Name: (2R)-2-[4-[2-(ethylamino)-2-oxoethyl]piperazin-4-ium-1-yl]-N-quinolin-5-ylpropanamide Traditional Name: (2R)-2-[4-[2-(ethylamino)-2-keto-ethyl]piperazin-4-ium-1-yl]-N-(5-quinolyl)propionamide Formula: C20H28N5O2+ MolecularWeight: 370.46862

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C[NH+]1CCN(CC1)C(C)C(=O)NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CCNC(=O)C[NH+]1CCN(CC1)[C@H](C)C(=O)NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C20H27N5O2/c1-3-21-19(26)14-24-10-12-25(13-11-24)15(2)20(27)23-18-8-4-7-17-16(18)6-5-9-22-17/h4-9,15H,3,10-14H2,1-2H3,(H,21,26)(H,23,27)/p+1/t15-/m1/s1