2-[2-[4-[2-[6-nitro-4-[(2-nitrophenyl)methyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine

Systemtic Name: 2-[2-[4-[2-[6-nitro-4-[(2-nitrophenyl)methyl]-3-oxidanylidene-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine Openeye Name: 2-[2-[4-[2-[6-nitro-4-[(2-nitrophenyl)methyl]-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine CAS Name: 2-[2-[4-[2-[6-nitro-4-[(2-nitrophenyl)methyl]-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine IUPAC Name: 2-[2-[4-[2-[6-nitro-4-[(2-nitrophenyl)methyl]-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine Traditional Name: 2-[2-[4-[2-[3-keto-6-nitro-4-(2-nitrobenzyl)-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethyl]guanidine Formula: C26H26N6O7 MolecularWeight: 534.52064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC(C2=O)CCOC4=CC=C(C=C4)CCN=C(N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])OC(C2=O)CCOC4=CC=C(C=C4)CCN=C(N)N)[N+](=O)[O-]

InChI

InChI=1S/C26H26N6O7/c27-26(28)29-13-11-17-5-8-20(9-6-17)38-14-12-24-25(33)30(16-18-3-1-2-4-21(18)32(36)37)22-15-19(31(34)35)7-10-23(22)39-24/h1-10,15,24H,11-14,16H2,(H4,27,28,29)