ethyl 2-[3-[[4-[(E)-diazanylidenemethyl]phenyl]methylamino]propanoylamino]-3-pyridin-3-yl-propanoate

Systemtic Name: ethyl 2-[3-[[4-[(E)-diazanylidenemethyl]phenyl]methylamino]propanoylamino]-3-pyridin-3-yl-propanoate Openeye Name: ethyl 2-[3-[[4-[(E)-hydrazinylidenemethyl]phenyl]methylamino]propanoylamino]-3-(3-pyridyl)propanoate CAS Name: 2-[[3-[[4-[(E)-hydrazinylidenemethyl]phenyl]methylamino]-1-oxopropyl]amino]-3-(3-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[3-[[4-[(E)-hydrazinylidenemethyl]phenyl]methylamino]propanoylamino]-3-pyridin-3-ylpropanoate Traditional Name: 2-[3-[[4-[(E)-hydrazonomethyl]benzyl]amino]propanoylamino]-3-(3-pyridyl)propionic acid ethyl ester Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CN=CC=C1)NC(=O)CCNCC2=CC=C(C=C2)C=NN

Isomeric SMILES

CCOC(=O)C(CC1=CN=CC=C1)NC(=O)CCNCC2=CC=C(C=C2)/C=N/N

InChI

InChI=1S/C21H27N5O3/c1-2-29-21(28)19(12-18-4-3-10-23-14-18)26-20(27)9-11-24-13-16-5-7-17(8-6-16)15-25-22/h3-8,10,14-15,19,24H,2,9,11-13,22H2,1H3,(H,26,27)/b25-15+