1,3-bis[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl]urea

Systemtic Name: 1,3-bis[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]propyl]urea Openeye Name: 1,3-bis[3-[(9,10-dioxo-1-anthryl)amino]propyl]urea CAS Name: 1,3-bis[3-[(9,10-dioxo-1-anthracenyl)amino]propyl]urea IUPAC Name: 1,3-bis[3-[(9,10-dioxoanthracen-1-yl)amino]propyl]urea Traditional Name: 1,3-bis[3-[(9,10-diketo-1-anthryl)amino]propyl]urea Formula: C35H30N4O5 MolecularWeight: 586.6365

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCNC(=O)NCCCNC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NCCCNC(=O)NCCCNC4=CC=CC5=C4C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C35H30N4O5/c40-31-21-9-1-3-11-23(21)33(42)29-25(31)13-5-15-27(29)36-17-7-19-38-35(44)39-20-8-18-37-28-16-6-14-26-30(28)34(43)24-12-4-2-10-22(24)32(26)41/h1-6,9-16,36-37H,7-8,17-20H2,(H2,38,39,44)