ethyl 4-[4-[(6-chloranyl-2H-chromen-3-yl)carbonylamino]butanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[(6-chloranyl-2H-chromen-3-yl)carbonylamino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[(6-chloro-2H-chromene-3-carbonyl)amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(6-chloro-2H-1-benzopyran-3-yl)-oxomethyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(6-chloro-2H-chromene-3-carbonyl)amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[(6-chloro-2H-chromene-3-carbonyl)amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C22H28ClN3O5 MolecularWeight: 449.92782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C22H28ClN3O5/c1-2-30-22(29)26-10-7-18(8-11-26)25-20(27)4-3-9-24-21(28)16-12-15-13-17(23)5-6-19(15)31-14-16/h5-6,12-13,18H,2-4,7-11,14H2,1H3,(H,24,28)(H,25,27)