tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methoxy-2-oxidanylidene-ethyl)carbamoylamino]butanoate

Systemtic Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methoxy-2-oxidanylidene-ethyl)carbamoylamino]butanoate Openeye Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methoxy-2-oxo-ethyl)carbamoylamino]butanoate CAS Name: (4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-[[[(2-methoxy-2-oxoethyl)amino]-oxomethyl]amino]butanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-methoxy-2-oxoethyl)carbamoylamino]butanoate Traditional Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-4-[(2-keto-2-methoxy-ethyl)carbamoylamino]butyric acid tert-butyl ester Formula: C27H33N3O7 MolecularWeight: 511.56682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(NC(=O)NCC(=O)OC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](NC(=O)NCC(=O)OC)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChI

InChI=1S/C27H33N3O7/c1-27(2,3)37-23(31)14-13-22(29-25(33)28-15-24(32)35-4)30-26(34)36-16-21-19-11-7-5-9-17(19)18-10-6-8-12-20(18)21/h5-12,21-22H,13-16H2,1-4H3,(H,30,34)(H2,28,29,33)/t22-/m0/s1