3-[2-[[3-(diazanylmethylideneamino)-4-methyl-phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid

Systemtic Name: 3-[2-[[3-(diazanylmethylideneamino)-4-methyl-phenyl]carbonylamino]ethanoylamino]-3-pyridin-3-yl-propanoic acid Openeye Name: 3-[[2-[[3-(hydrazinomethyleneamino)-4-methyl-benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propanoic acid CAS Name: 3-[[2-[[[3-(hydrazinylmethylideneamino)-4-methylphenyl]-oxomethyl]amino]-1-oxoethyl]amino]-3-(3-pyridinyl)propanoic acid IUPAC Name: 3-[[2-[[3-(hydrazinylmethylideneamino)-4-methylbenzoyl]amino]acetyl]amino]-3-pyridin-3-ylpropanoic acid Traditional Name: 3-[[2-[[3-(hydrazinomethyleneamino)-4-methyl-benzoyl]amino]acetyl]amino]-3-(3-pyridyl)propionic acid Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC(CC(=O)O)C2=CN=CC=C2)N=CNN

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC(CC(=O)O)C2=CN=CC=C2)N=CNN

InChI

InChI=1S/C19H22N6O4/c1-12-4-5-13(7-15(12)23-11-24-20)19(29)22-10-17(26)25-16(8-18(27)28)14-3-2-6-21-9-14/h2-7,9,11,16H,8,10,20H2,1H3,(H,22,29)(H,23,24)(H,25,26)(H,27,28)