hexan-2-yl 2-azanyl-5-[[azanyl-(9H-fluoren-9-ylmethoxycarbonylamino)methylidene]amino]pentanoate

Systemtic Name: hexan-2-yl 2-azanyl-5-[[azanyl-(9H-fluoren-9-ylmethoxycarbonylamino)methylidene]amino]pentanoate Openeye Name: 1-methylpentyl 2-amino-5-[[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylene]amino]pentanoate CAS Name: 2-amino-5-[[amino-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]methylidene]amino]pentanoic acid hexan-2-yl ester IUPAC Name: hexan-2-yl 2-amino-5-[[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylidene]amino]pentanoate Traditional Name: 2-amino-5-[[amino-(9H-fluoren-9-ylmethoxycarbonylamino)methylene]amino]valeric acid 1-methylpentyl ester Formula: C27H36N4O4 MolecularWeight: 480.59914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)OC(=O)C(CCCN=C(N)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)N

Isomeric SMILES

CCCCC(C)OC(=O)C(CCCN=C(N)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)N

InChI

InChI=1S/C27H36N4O4/c1-3-4-10-18(2)35-25(32)24(28)15-9-16-30-26(29)31-27(33)34-17-23-21-13-7-5-11-19(21)20-12-6-8-14-22(20)23/h5-8,11-14,18,23-24H,3-4,9-10,15-17,28H2,1-2H3,(H3,29,30,31,33)