ethyl 3-[6-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]hexylamino]-3-oxidanylidene-2-phenyl-propanoate

Systemtic Name: ethyl 3-[6-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]hexylamino]-3-oxidanylidene-2-phenyl-propanoate Openeye Name: ethyl 3-[6-[bis(tert-butoxycarbonylamino)methyleneamino]hexylamino]-3-oxo-2-phenyl-propanoate CAS Name: 3-[6-[bis[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methylideneamino]hexylamino]-3-oxo-2-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 3-[6-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]hexylamino]-3-oxo-2-phenylpropanoate Traditional Name: 3-[6-[bis(tert-butoxycarbonylamino)methyleneamino]hexylamino]-3-keto-2-phenyl-propionic acid ethyl ester Formula: C28H44N4O7 MolecularWeight: 548.67156

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)C(=O)NCCCCCCN=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)C(=O)NCCCCCCN=C(NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C28H44N4O7/c1-8-37-23(34)21(20-16-12-11-13-17-20)22(33)29-18-14-9-10-15-19-30-24(31-25(35)38-27(2,3)4)32-26(36)39-28(5,6)7/h11-13,16-17,21H,8-10,14-15,18-19H2,1-7H3,(H,29,33)(H2,30,31,32,35,36)