propyl N-[2,5-bis(aziridin-1-yl)-3,6-bis(oxidanylidene)-4-(propoxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamate

Systemtic Name: propyl N-[2,5-bis(aziridin-1-yl)-3,6-bis(oxidanylidene)-4-(propoxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamate Openeye Name: propyl N-[2,5-bis(aziridin-1-yl)-3,6-dioxo-4-(propoxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamate CAS Name: N-[2,5-bis(1-aziridinyl)-3,6-dioxo-4-[[oxo(propoxy)methyl]amino]-1-cyclohexa-1,4-dienyl]carbamic acid propyl ester IUPAC Name: propyl N-[2,5-bis(aziridin-1-yl)-3,6-dioxo-4-(propoxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamate Traditional Name: N-[2,5-diethylenimino-3,6-diketo-4-(propoxycarbonylamino)cyclohexa-1,4-dien-1-yl]carbamic acid propyl ester Formula: C18H24N4O6 MolecularWeight: 392.40636

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OCCC)N3CC3

Isomeric SMILES

CCCOC(=O)NC1=C(C(=O)C(=C(C1=O)N2CC2)NC(=O)OCCC)N3CC3

InChI

InChI=1S/C18H24N4O6/c1-3-9-27-17(25)19-11-13(21-5-6-21)16(24)12(20-18(26)28-10-4-2)14(15(11)23)22-7-8-22/h3-10H2,1-2H3,(H,19,25)(H,20,26)