(3S)-N-(3-chloranyl-4-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide

Systemtic Name: (3S)-N-(3-chloranyl-4-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide Openeye Name: (3S)-N-(3-chloro-4-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide CAS Name: (3S)-N-(3-chloro-4-methoxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-1-piperidinecarboxamide IUPAC Name: (3S)-N-(3-chloro-4-methoxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide Traditional Name: (3S)-N-(3-chloro-4-methoxy-phenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)piperidine-1-carboxamide Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)N2CCCC(C2)NC3=CC4=C(C=C3)OCCO4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)N2CCC[C@@H](C2)NC3=CC4=C(C=C3)OCCO4)Cl

InChI

InChI=1S/C21H24ClN3O4/c1-27-18-6-4-14(11-17(18)22)24-21(26)25-8-2-3-16(13-25)23-15-5-7-19-20(12-15)29-10-9-28-19/h4-7,11-12,16,23H,2-3,8-10,13H2,1H3,(H,24,26)/t16-/m0/s1