3-oxidanylidene-3-[2-[4-(phenylcarbamoylamino)phenyl]hydrazinyl]-N-pyridin-1-ium-4-yl-propanamide

Systemtic Name: 3-oxidanylidene-3-[2-[4-(phenylcarbamoylamino)phenyl]hydrazinyl]-N-pyridin-1-ium-4-yl-propanamide Openeye Name: 3-oxo-3-[2-[4-(phenylcarbamoylamino)phenyl]hydrazino]-N-pyridin-1-ium-4-yl-propanamide CAS Name: 3-[[4-[[anilino(oxo)methyl]amino]phenyl]hydrazo]-3-oxo-N-(4-pyridin-1-iumyl)propanamide IUPAC Name: 3-oxo-3-[2-[4-(phenylcarbamoylamino)phenyl]hydrazinyl]-N-pyridin-1-ium-4-ylpropanamide Traditional Name: 3-keto-3-[N'-[4-(phenylcarbamoylamino)phenyl]hydrazino]-N-pyridin-1-ium-4-yl-propionamide Formula: C21H21N6O3+ MolecularWeight: 405.42984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NNC(=O)CC(=O)NC3=CC=[NH+]C=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NNC(=O)CC(=O)NC3=CC=[NH+]C=C3

InChI

InChI=1S/C21H20N6O3/c28-19(23-17-10-12-22-13-11-17)14-20(29)27-26-18-8-6-16(7-9-18)25-21(30)24-15-4-2-1-3-5-15/h1-13,26H,14H2,(H,27,29)(H,22,23,28)(H2,24,25,30)/p+1