tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(4-methylpiperazin-1-yl)pentanoate

Systemtic Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(4-methylpiperazin-1-yl)pentanoate Openeye Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(4-methylpiperazin-1-yl)pentanoate CAS Name: (4S)-4-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-5-(4-methyl-1-piperazinyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(4-methylpiperazin-1-yl)pentanoate Traditional Name: (4S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-(4-methylpiperazino)valeric acid tert-butyl ester Formula: C29H39N3O4 MolecularWeight: 493.63766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC(CN1CCN(CC1)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

Isomeric SMILES

CC(C)(C)OC(=O)CC[C@@H](CN1CCN(CC1)C)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24

InChI

InChI=1S/C29H39N3O4/c1-29(2,3)36-27(33)14-13-21(19-32-17-15-31(4)16-18-32)30-28(34)35-20-26-24-11-7-5-9-22(24)23-10-6-8-12-25(23)26/h5-12,21,26H,13-20H2,1-4H3,(H,30,34)/t21-/m0/s1