tert-butyl 4-[1-azanyl-2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-azanyl-2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxidanylidene-ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[1-amino-2-(indan-5-ylamino)-2-oxo-ethyl]piperidine-1-carboxylate CAS Name: 4-[1-amino-2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-amino-2-(2,3-dihydro-1H-inden-5-ylamino)-2-oxoethyl]piperidine-1-carboxylate Traditional Name: 4-[1-amino-2-(indan-5-ylamino)-2-keto-ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(C(=O)NC2=CC3=C(CCC3)C=C2)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(C(=O)NC2=CC3=C(CCC3)C=C2)N

InChI

InChI=1S/C21H31N3O3/c1-21(2,3)27-20(26)24-11-9-15(10-12-24)18(22)19(25)23-17-8-7-14-5-4-6-16(14)13-17/h7-8,13,15,18H,4-6,9-12,22H2,1-3H3,(H,23,25)