2-(2-nitro-5-spiro[1,3-benzoselenazole-2,2'-chromene]-3-yl-heptyl)dodecyl 2-methylprop-2-enoate

Systemtic Name: 2-(2-nitro-5-spiro[1,3-benzoselenazole-2,2'-chromene]-3-yl-heptyl)dodecyl 2-methylprop-2-enoate Openeye Name: 2-(2-nitro-5-spiro[1,3-benzoselenazole-2,2'-chromene]-3-yl-heptyl)dodecyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 2-[2-nitro-5-(3-spiro[1,3-benzoselenazole-2,2'-1-benzopyran]yl)heptyl]dodecyl ester IUPAC Name: 2-(2-nitro-5-spiro[1,3-benzoselenazole-2,2'-chromene]-3-ylheptyl)dodecyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 2-(2-nitro-5-spiro[1,3-benzoselenazole-2,2'-chromene]-3-yl-heptyl)dodecyl ester Formula: C38H52N2O5Se MolecularWeight: 695.78988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC(CCC(CC)N1C2=CC=CC=C2[Se]C13C=CC4=CC=CC=C4O3)[N+](=O)[O-])COC(=O)C(=C)C

Isomeric SMILES

CCCCCCCCCCC(CC(CCC(CC)N1C2=CC=CC=C2[Se]C13C=CC4=CC=CC=C4O3)[N+](=O)[O-])COC(=O)C(=C)C

InChI

InChI=1S/C38H52N2O5Se/c1-5-7-8-9-10-11-12-13-18-30(28-44-37(41)29(3)4)27-33(40(42)43)24-23-32(6-2)39-34-20-15-17-22-36(34)46-38(39)26-25-31-19-14-16-21-35(31)45-38/h14-17,19-22,25-26,30,32-33H,3,5-13,18,23-24,27-28H2,1-2,4H3