1-(8,8-dimethyl-2-propan-2-yl-7,9-dioxaspiro[4.5]decan-3-ylidene)hex-1-en-2-yl 4-nitrobenzoate

Systemtic Name: 1-(8,8-dimethyl-2-propan-2-yl-7,9-dioxaspiro[4.5]decan-3-ylidene)hex-1-en-2-yl 4-nitrobenzoate Openeye Name: 1-[(2-isopropyl-8,8-dimethyl-7,9-dioxaspiro[4.5]decan-3-ylidene)methylene]pentyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 1-(8,8-dimethyl-2-propan-2-yl-7,9-dioxaspiro[4.5]decan-3-ylidene)hex-1-en-2-yl ester IUPAC Name: 1-(8,8-dimethyl-2-propan-2-yl-7,9-dioxaspiro[4.5]decan-3-ylidene)hex-1-en-2-yl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [1-butyl-2-(2-isopropyl-8,8-dimethyl-7,9-dioxaspiro[4.5]decan-3-ylidene)vinyl] ester Formula: C26H35NO6 MolecularWeight: 457.5592

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C=C1CC2(CC1C(C)C)COC(OC2)(C)C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=C=C1CC2(CC1C(C)C)COC(OC2)(C)C)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H35NO6/c1-6-7-8-22(33-24(28)19-9-11-21(12-10-19)27(29)30)13-20-14-26(15-23(20)18(2)3)16-31-25(4,5)32-17-26/h9-12,18,23H,6-8,14-17H2,1-5H3