tert-butyl N-[(2S)-4-methyl-1-[(5-methyl-3-oxidanyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-4-methyl-1-[(5-methyl-3-oxidanyl-azepan-4-yl)amino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-1-[(3-hydroxy-5-methyl-azepan-4-yl)carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2S)-1-[(3-hydroxy-5-methyl-4-azepanyl)amino]-4-methyl-1-oxopentan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[(3-hydroxy-5-methylazepan-4-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(3-hydroxy-5-methyl-azepan-4-yl)carbamoyl]-3-methyl-butyl]carbamic acid tert-butyl ester Formula: C18H35N3O4 MolecularWeight: 357.4882

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCNCC(C1NC(=O)C(CC(C)C)NC(=O)OC(C)(C)C)O

Isomeric SMILES

CC1CCNCC(C1NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C18H35N3O4/c1-11(2)9-13(20-17(24)25-18(4,5)6)16(23)21-15-12(3)7-8-19-10-14(15)22/h11-15,19,22H,7-10H2,1-6H3,(H,20,24)(H,21,23)/t12?,13-,14?,15?/m0/s1