ethyl 5-chloranyl-6-[3-(phenylcarbamoylamino)azetidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-chloranyl-6-[3-(phenylcarbamoylamino)azetidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-chloro-6-[3-(phenylcarbamoylamino)azetidin-1-yl]pyridine-3-carboxylate CAS Name: 6-[3-[[anilino(oxo)methyl]amino]-1-azetidinyl]-5-chloro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-chloro-6-[3-(phenylcarbamoylamino)azetidin-1-yl]pyridine-3-carboxylate Traditional Name: 5-chloro-6-[3-(phenylcarbamoylamino)azetidin-1-yl]nicotinic acid ethyl ester Formula: C18H19ClN4O3 MolecularWeight: 374.82146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1)N2CC(C2)NC(=O)NC3=CC=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1)N2CC(C2)NC(=O)NC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H19ClN4O3/c1-2-26-17(24)12-8-15(19)16(20-9-12)23-10-14(11-23)22-18(25)21-13-6-4-3-5-7-13/h3-9,14H,2,10-11H2,1H3,(H2,21,22,25)