3-[2-[[4-[(E)-diazanylidenemethyl]phenyl]carbamoylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[2-[[4-[(E)-diazanylidenemethyl]phenyl]carbamoylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[2-[[4-[(E)-hydrazinylidenemethyl]phenyl]carbamoylamino]acetyl]amino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[2-[[[4-[(E)-hydrazinylidenemethyl]anilino]-oxomethyl]amino]-1-oxoethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[2-[[4-[(E)-hydrazinylidenemethyl]phenyl]carbamoylamino]acetyl]amino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[2-[[4-[(E)-hydrazonomethyl]phenyl]carbamoylamino]acetyl]amino]-3-(3-pyridyl)propionic acid Formula: C18H20N6O4 MolecularWeight: 384.3892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CC(=O)O)NC(=O)CNC(=O)NC2=CC=C(C=C2)C=NN

Isomeric SMILES

C1=CC(=CN=C1)C(CC(=O)O)NC(=O)CNC(=O)NC2=CC=C(C=C2)/C=N/N

InChI

InChI=1S/C18H20N6O4/c19-22-9-12-3-5-14(6-4-12)23-18(28)21-11-16(25)24-15(8-17(26)27)13-2-1-7-20-10-13/h1-7,9-10,15H,8,11,19H2,(H,24,25)(H,26,27)(H2,21,23,28)/b22-9+