1-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)methylcarbamoylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)methylcarbamoylamino]cycloheptanecarboxylic acid CAS Name: 1-[[[(5-chloro-2-thiophenyl)methylamino]-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)methylcarbamoylamino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)methylcarbamoylamino]cycloheptanecarboxylic acid Formula: C14H19ClN2O3S MolecularWeight: 330.83026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)NCC2=CC=C(S2)Cl

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)NCC2=CC=C(S2)Cl

InChI

InChI=1S/C14H19ClN2O3S/c15-11-6-5-10(21-11)9-16-13(20)17-14(12(18)19)7-3-1-2-4-8-14/h5-6H,1-4,7-9H2,(H,18,19)(H2,16,17,20)